Found 110 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50184359
((3S,6S,9R,12S,15S,23S)-15-((S)-2-acetylamino-hexan...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r,wU:21.75,50.52,12.11,4.4,39.41,wD:25.25,61.64,(19.68,-11.7,;18.32,-10.97,;18.27,-9.43,;16.91,-8.71,;16.86,-7.17,;18.17,-6.36,;18.11,-4.82,;19.42,-4,;16.76,-4.09,;15.5,-6.44,;15.45,-4.9,;14.19,-7.26,;12.83,-6.53,;11.53,-7.35,;11.58,-8.88,;12.94,-9.61,;10.27,-9.7,;8.91,-8.97,;7.6,-9.79,;6.25,-9.06,;4.94,-9.87,;3.58,-9.15,;3.53,-7.61,;2.17,-6.88,;.86,-7.7,;2.12,-5.35,;.76,-4.62,;.71,-3.08,;1.93,-2.14,;1.41,-.69,;-.14,-.74,;-1.21,.35,;-2.69,-.02,;-3.1,-1.51,;-2.03,-2.6,;-.56,-2.22,;3.43,-4.53,;4.79,-5.26,;4.84,-6.8,;6.98,-5.22,;8.76,-4.36,;10.12,-5.08,;10.17,-6.62,;8.86,-7.43,;7.5,-6.71,;6.19,-7.52,;8.83,-5.93,;6.09,-4.44,;6.04,-2.9,;4.68,-2.18,;7.35,-2.09,;7.3,-.55,;5.94,.17,;5.89,1.71,;4.53,2.44,;3.23,1.62,;3.28,.07,;4.64,-.64,;8.71,-2.82,;10.02,-2,;9.96,-.46,;11.37,-2.73,;12.68,-1.91,;12.64,-.37,;13.86,.56,;13.35,2.01,;11.81,1.97,;11.37,.5,;11.42,-4.27,;12.78,-4.99,;14.09,-4.18,;2.27,-9.96,;.91,-9.24,;2.32,-11.5,)| Show InChI InChI=1S/C50H69N15O9/c1-3-4-16-36(59-29(2)66)44(69)65-41-25-42(67)55-20-11-10-18-35(43(51)68)60-47(72)39(23-31-26-57-34-17-9-8-15-33(31)34)63-45(70)37(19-12-21-56-50(52)53)61-46(71)38(22-30-13-6-5-7-14-30)62-48(73)40(64-49(41)74)24-32-27-54-28-58-32/h5-9,13-15,17,26-28,35-41,57H,3-4,10-12,16,18-25H2,1-2H3,(H2,51,68)(H,54,58)(H,55,67)(H,59,66)(H,60,72)(H,61,71)(H,62,73)(H,63,70)(H,64,74)(H,65,69)(H4,52,53,56)/t35-,36-,37-,38+,39-,40-,41-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 0.200 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268806
(Ac-Tyr-Val-Nle-Gly-His-DPhe-Arg-Trp-Asp-Arg-Phe-Gl...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r,wU:12.21,56.58,35.35,81.85,45.46,4.4,100.104,wD:67.69,8.8,89.93,(6.82,-32.01,;5.49,-32.78,;5.49,-34.31,;4.16,-35.09,;4.16,-36.62,;2.82,-37.38,;1.49,-36.61,;1.49,-35.08,;.16,-37.38,;-1.17,-36.62,;-2.5,-37.4,;-2.5,-38.94,;-3.83,-36.63,;-3.83,-35.09,;-2.49,-34.32,;-1.16,-35.09,;.18,-34.32,;.18,-32.78,;1.51,-32,;-1.15,-32.01,;-2.49,-32.78,;-5.18,-37.37,;-6.51,-36.6,;-7.85,-37.37,;-6.51,-35.06,;.16,-38.93,;1.49,-39.69,;-1.18,-39.7,;5.49,-37.39,;5.49,-38.94,;6.83,-36.63,;8.16,-37.4,;9.49,-36.63,;9.49,-35.09,;10.83,-37.4,;12.17,-36.64,;12.17,-35.1,;13.5,-34.33,;14.91,-34.96,;15.95,-33.81,;15.17,-32.48,;13.66,-32.79,;13.5,-37.41,;13.5,-38.95,;14.83,-36.63,;16.17,-37.4,;16.17,-38.95,;17.5,-39.71,;18.84,-38.95,;20.17,-39.72,;20.17,-41.26,;18.83,-42.03,;17.5,-41.26,;17.5,-36.63,;17.5,-35.1,;18.83,-37.4,;20.18,-36.65,;20.18,-35.11,;21.51,-34.34,;21.51,-32.81,;22.84,-32.03,;22.85,-30.49,;21.51,-29.71,;24.18,-29.72,;21.51,-37.42,;21.51,-38.97,;22.84,-36.64,;24.17,-37.41,;24.17,-38.95,;25.5,-39.72,;26.91,-39.1,;27.94,-40.24,;27.17,-41.58,;27.64,-43.04,;26.61,-44.18,;25.1,-43.86,;24.63,-42.39,;25.66,-41.25,;25.5,-36.64,;25.5,-35.1,;26.84,-37.41,;28.17,-36.64,;28.17,-35.11,;29.5,-34.34,;30.83,-35.11,;29.5,-32.8,;29.5,-37.42,;29.5,-38.96,;30.84,-36.64,;32.17,-37.41,;32.17,-38.96,;33.49,-39.72,;33.49,-41.27,;34.82,-42.04,;34.83,-43.58,;33.49,-44.35,;36.16,-44.35,;33.49,-36.64,;33.49,-35.11,;34.83,-37.41,;36.16,-36.64,;36.16,-35.1,;37.5,-34.34,;38.83,-35.11,;40.16,-34.34,;40.17,-32.8,;38.84,-32.03,;37.5,-32.79,;37.5,-37.42,;37.5,-38.95,;38.83,-36.64,;40.16,-37.41,;41.48,-36.64,;42.83,-37.42,;41.48,-35.11,)| Show InChI InChI=1S/C77H104N22O16/c1-5-6-22-53(94-75(115)65(43(2)3)99-74(114)57(90-44(4)100)34-47-26-28-50(101)29-27-47)66(106)88-41-63(103)91-60(36-49-39-83-42-89-49)72(112)96-58(33-46-19-11-8-12-20-46)70(110)92-55(25-16-31-85-77(81)82)69(109)97-59(35-48-38-86-52-23-14-13-21-51(48)52)71(111)98-61(37-64(104)105)73(113)93-54(24-15-30-84-76(79)80)68(108)95-56(67(107)87-40-62(78)102)32-45-17-9-7-10-18-45/h7-14,17-21,23,26-29,38-39,42-43,53-61,65,86,101H,5-6,15-16,22,24-25,30-37,40-41H2,1-4H3,(H2,78,102)(H,83,89)(H,87,107)(H,88,106)(H,90,100)(H,91,103)(H,92,110)(H,93,113)(H,94,115)(H,95,108)(H,96,112)(H,97,109)(H,98,111)(H,99,114)(H,104,105)(H4,79,80,84)(H4,81,82,85)/t53-,54-,55-,56-,57-,58+,59-,60-,61-,65-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50121268
(21-(2-Acetylamino-hexanoylamino)-7-[3-(diaminometh...)Show SMILES CCCC[C@@H](NC(C)=O)C(=O)N[C@@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O Show InChI InChI=1S/C54H71N15O9/c1-3-4-15-40(63-31(2)70)48(73)69-45-27-46(71)59-21-10-9-17-39(47(55)72)64-51(76)43(25-35-28-61-38-16-8-7-14-37(35)38)67-49(74)41(18-11-22-60-54(56)57)65-50(75)42(24-32-19-20-33-12-5-6-13-34(33)23-32)66-52(77)44(68-53(45)78)26-36-29-58-30-62-36/h5-8,12-14,16,19-20,23,28-30,39-45,61H,3-4,9-11,15,17-18,21-22,24-27H2,1-2H3,(H2,55,72)(H,58,62)(H,59,71)(H,63,70)(H,64,76)(H,65,75)(H,66,77)(H,67,74)(H,68,78)(H,69,73)(H4,56,57,60)/t39-,40+,41-,42+,43-,44-,45+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.600 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC4R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268795
(Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DPhe-Arg-Trp-L...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,63.72,12.11,21.76,wD:25.25,39.41,61.68,(21.05,-10.24,;19.69,-9.52,;19.64,-7.97,;18.28,-7.25,;18.23,-5.71,;19.54,-4.89,;19.48,-3.35,;20.79,-2.54,;18.13,-2.63,;16.87,-4.98,;16.82,-3.44,;15.56,-5.8,;14.2,-5.07,;12.89,-5.89,;12.94,-7.43,;14.3,-8.15,;11.63,-8.24,;10.27,-7.52,;8.96,-8.33,;7.6,-7.6,;6.29,-8.41,;4.93,-7.69,;4.88,-6.15,;3.52,-5.42,;2.21,-6.24,;3.47,-3.88,;2.1,-3.15,;.64,-3.65,;-.62,-2.76,;-1.85,-3.68,;-1.35,-5.15,;-2.08,-6.49,;-1.28,-7.8,;.26,-7.76,;.99,-6.41,;.19,-5.12,;4.78,-3.07,;6.1,-3.3,;7.43,-4.09,;4.73,-1.52,;3.37,-.8,;3.32,.74,;1.96,1.47,;1.91,3.01,;.54,3.73,;.5,5.28,;-.76,2.92,;6.03,-.71,;7.4,-1.43,;7.45,-2.98,;8.71,-.62,;8.66,.92,;7.3,1.65,;7.25,3.18,;5.89,3.91,;4.58,3.1,;4.63,1.55,;5.98,.83,;10.06,-1.35,;11.38,-.54,;11.33,1.01,;12.75,-1.27,;13.83,-.17,;15.32,-.56,;15.32,-2.1,;12.78,-2.79,;14.15,-3.53,;15.45,-2.72,;16.54,.37,;16.34,1.9,;14.92,2.5,;17.57,2.84,;3.63,-8.5,;2.26,-7.78,;3.67,-10.04,)| Show InChI InChI=1S/C50H72N16O9/c1-3-4-16-35(59-28(2)67)43(70)65-39-25-41(68)56-20-11-10-18-34(42(51)69)61-46(73)38(23-30-26-58-33-17-9-8-15-32(30)33)63-44(71)36(19-12-21-57-49(52)53)62-45(72)37(22-29-13-6-5-7-14-29)64-47(74)40-24-31(60-50(54)55)27-66(40)48(39)75/h5-9,13-15,17,26,31,34-40,58H,3-4,10-12,16,18-25,27H2,1-2H3,(H2,51,69)(H,56,68)(H,59,67)(H,61,73)(H,62,72)(H,63,71)(H,64,74)(H,65,70)(H4,52,53,57)(H4,54,55,60)/t31-,34+,35+,36+,37-,38+,39+,40+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.600 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC4R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268801
(Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DNal(2')-Arg-T...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,12.11,67.77,21.81,50.52,wD:25.25,39.41,65.73,(14,-47.54,;12.64,-46.82,;12.59,-45.28,;11.23,-44.55,;11.18,-43.02,;12.48,-42.2,;12.43,-40.66,;13.74,-39.85,;11.08,-39.94,;9.82,-42.29,;9.77,-40.75,;8.51,-43.1,;7.15,-42.38,;5.85,-43.19,;5.9,-44.73,;7.25,-45.46,;4.58,-45.55,;3.23,-44.82,;1.92,-45.64,;.56,-44.9,;-.75,-45.72,;-2.1,-44.99,;-2.16,-43.45,;-3.51,-42.73,;-4.83,-43.54,;-3.56,-41.19,;-4.94,-40.46,;-6.39,-40.96,;-7.65,-40.07,;-8.88,-40.99,;-8.38,-42.46,;-9.11,-43.8,;-8.32,-45.1,;-6.78,-45.06,;-6.05,-43.72,;-6.84,-42.42,;-2.26,-40.37,;-.94,-40.6,;.38,-41.4,;-2.31,-38.83,;-3.67,-38.11,;-3.72,-36.57,;-5.08,-35.85,;-5.13,-34.31,;-6.49,-33.58,;-6.54,-32.04,;-7.8,-34.4,;-1,-38.02,;.36,-38.75,;.41,-40.29,;1.67,-37.93,;1.61,-36.39,;.26,-35.67,;-1.06,-36.48,;-2.41,-35.77,;-2.46,-34.22,;-3.82,-33.49,;-3.87,-31.96,;-2.55,-31.14,;-1.19,-31.87,;-1.15,-33.41,;.21,-34.13,;3.02,-38.66,;4.34,-37.85,;4.28,-36.3,;5.7,-38.58,;6.78,-37.48,;8.27,-37.87,;8.27,-39.41,;5.74,-40.1,;7.1,-40.84,;8.41,-40.03,;9.5,-36.94,;9.3,-35.41,;7.88,-34.82,;10.52,-34.48,;-3.41,-45.81,;-4.77,-45.08,;-3.37,-47.35,)| Show InChI InChI=1S/C54H74N16O9/c1-3-4-15-39(63-30(2)71)47(74)69-43-27-45(72)60-21-10-9-17-38(46(55)73)65-50(77)42(25-34-28-62-37-16-8-7-14-36(34)37)67-48(75)40(18-11-22-61-53(56)57)66-49(76)41(24-31-19-20-32-12-5-6-13-33(32)23-31)68-51(78)44-26-35(64-54(58)59)29-70(44)52(43)79/h5-8,12-14,16,19-20,23,28,35,38-44,62H,3-4,9-11,15,17-18,21-22,24-27,29H2,1-2H3,(H2,55,73)(H,60,72)(H,63,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,56,57,61)(H4,58,59,64)/t35-,38+,39+,40+,41-,42+,43+,44+/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.700 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC5R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50121268
(21-(2-Acetylamino-hexanoylamino)-7-[3-(diaminometh...)Show SMILES CCCC[C@@H](NC(C)=O)C(=O)N[C@@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O Show InChI InChI=1S/C54H71N15O9/c1-3-4-15-40(63-31(2)70)48(73)69-45-27-46(71)59-21-10-9-17-39(47(55)72)64-51(76)43(25-35-28-61-38-16-8-7-14-37(35)38)67-49(74)41(18-11-22-60-54(56)57)65-50(75)42(24-32-19-20-33-12-5-6-13-34(33)23-32)66-52(77)44(68-53(45)78)26-36-29-58-30-62-36/h5-8,12-14,16,19-20,23,28-30,39-45,61H,3-4,9-11,15,17-18,21-22,24-27H2,1-2H3,(H2,55,72)(H,58,62)(H,59,71)(H,63,70)(H,64,76)(H,65,75)(H,66,77)(H,67,74)(H,68,78)(H,69,73)(H4,56,57,60)/t39-,40+,41-,42+,43-,44-,45+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.900 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC5R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268795
(Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DPhe-Arg-Trp-L...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,63.72,12.11,21.76,wD:25.25,39.41,61.68,(21.05,-10.24,;19.69,-9.52,;19.64,-7.97,;18.28,-7.25,;18.23,-5.71,;19.54,-4.89,;19.48,-3.35,;20.79,-2.54,;18.13,-2.63,;16.87,-4.98,;16.82,-3.44,;15.56,-5.8,;14.2,-5.07,;12.89,-5.89,;12.94,-7.43,;14.3,-8.15,;11.63,-8.24,;10.27,-7.52,;8.96,-8.33,;7.6,-7.6,;6.29,-8.41,;4.93,-7.69,;4.88,-6.15,;3.52,-5.42,;2.21,-6.24,;3.47,-3.88,;2.1,-3.15,;.64,-3.65,;-.62,-2.76,;-1.85,-3.68,;-1.35,-5.15,;-2.08,-6.49,;-1.28,-7.8,;.26,-7.76,;.99,-6.41,;.19,-5.12,;4.78,-3.07,;6.1,-3.3,;7.43,-4.09,;4.73,-1.52,;3.37,-.8,;3.32,.74,;1.96,1.47,;1.91,3.01,;.54,3.73,;.5,5.28,;-.76,2.92,;6.03,-.71,;7.4,-1.43,;7.45,-2.98,;8.71,-.62,;8.66,.92,;7.3,1.65,;7.25,3.18,;5.89,3.91,;4.58,3.1,;4.63,1.55,;5.98,.83,;10.06,-1.35,;11.38,-.54,;11.33,1.01,;12.75,-1.27,;13.83,-.17,;15.32,-.56,;15.32,-2.1,;12.78,-2.79,;14.15,-3.53,;15.45,-2.72,;16.54,.37,;16.34,1.9,;14.92,2.5,;17.57,2.84,;3.63,-8.5,;2.26,-7.78,;3.67,-10.04,)| Show InChI InChI=1S/C50H72N16O9/c1-3-4-16-35(59-28(2)67)43(70)65-39-25-41(68)56-20-11-10-18-34(42(51)69)61-46(73)38(23-30-26-58-33-17-9-8-15-32(30)33)63-44(71)36(19-12-21-57-49(52)53)62-45(72)37(22-29-13-6-5-7-14-29)64-47(74)40-24-31(60-50(54)55)27-66(40)48(39)75/h5-9,13-15,17,26,31,34-40,58H,3-4,10-12,16,18-25,27H2,1-2H3,(H2,51,69)(H,56,68)(H,59,67)(H,61,73)(H,62,72)(H,63,71)(H,64,74)(H,65,70)(H4,52,53,57)(H4,54,55,60)/t31-,34+,35+,36+,37-,38+,39+,40+/m1/s1 | PDB
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University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC3R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50121268
(21-(2-Acetylamino-hexanoylamino)-7-[3-(diaminometh...)Show SMILES CCCC[C@@H](NC(C)=O)C(=O)N[C@@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O Show InChI InChI=1S/C54H71N15O9/c1-3-4-15-40(63-31(2)70)48(73)69-45-27-46(71)59-21-10-9-17-39(47(55)72)64-51(76)43(25-35-28-61-38-16-8-7-14-37(35)38)67-49(74)41(18-11-22-60-54(56)57)65-50(75)42(24-32-19-20-33-12-5-6-13-34(33)23-32)66-52(77)44(68-53(45)78)26-36-29-58-30-62-36/h5-8,12-14,16,19-20,23,28-30,39-45,61H,3-4,9-11,15,17-18,21-22,24-27H2,1-2H3,(H2,55,72)(H,58,62)(H,59,71)(H,63,70)(H,64,76)(H,65,75)(H,66,77)(H,67,74)(H,68,78)(H,69,73)(H4,56,57,60)/t39-,40+,41-,42+,43-,44-,45+/m0/s1 | PDB
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University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC1R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50184359
((3S,6S,9R,12S,15S,23S)-15-((S)-2-acetylamino-hexan...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r,wU:21.75,50.52,12.11,4.4,39.41,wD:25.25,61.64,(19.68,-11.7,;18.32,-10.97,;18.27,-9.43,;16.91,-8.71,;16.86,-7.17,;18.17,-6.36,;18.11,-4.82,;19.42,-4,;16.76,-4.09,;15.5,-6.44,;15.45,-4.9,;14.19,-7.26,;12.83,-6.53,;11.53,-7.35,;11.58,-8.88,;12.94,-9.61,;10.27,-9.7,;8.91,-8.97,;7.6,-9.79,;6.25,-9.06,;4.94,-9.87,;3.58,-9.15,;3.53,-7.61,;2.17,-6.88,;.86,-7.7,;2.12,-5.35,;.76,-4.62,;.71,-3.08,;1.93,-2.14,;1.41,-.69,;-.14,-.74,;-1.21,.35,;-2.69,-.02,;-3.1,-1.51,;-2.03,-2.6,;-.56,-2.22,;3.43,-4.53,;4.79,-5.26,;4.84,-6.8,;6.98,-5.22,;8.76,-4.36,;10.12,-5.08,;10.17,-6.62,;8.86,-7.43,;7.5,-6.71,;6.19,-7.52,;8.83,-5.93,;6.09,-4.44,;6.04,-2.9,;4.68,-2.18,;7.35,-2.09,;7.3,-.55,;5.94,.17,;5.89,1.71,;4.53,2.44,;3.23,1.62,;3.28,.07,;4.64,-.64,;8.71,-2.82,;10.02,-2,;9.96,-.46,;11.37,-2.73,;12.68,-1.91,;12.64,-.37,;13.86,.56,;13.35,2.01,;11.81,1.97,;11.37,.5,;11.42,-4.27,;12.78,-4.99,;14.09,-4.18,;2.27,-9.96,;.91,-9.24,;2.32,-11.5,)| Show InChI InChI=1S/C50H69N15O9/c1-3-4-16-36(59-29(2)66)44(69)65-41-25-42(67)55-20-11-10-18-35(43(51)68)60-47(72)39(23-31-26-57-34-17-9-8-15-33(31)34)63-45(70)37(19-12-21-56-50(52)53)61-46(71)38(22-30-13-6-5-7-14-30)62-48(73)40(64-49(41)74)24-32-27-54-28-58-32/h5-9,13-15,17,26-28,35-41,57H,3-4,10-12,16,18-25H2,1-2H3,(H2,51,68)(H,54,58)(H,55,67)(H,59,66)(H,60,72)(H,61,71)(H,62,73)(H,63,70)(H,64,74)(H,65,69)(H4,52,53,56)/t35-,36-,37-,38+,39-,40-,41-/m0/s1 | PDB
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| n/a | n/a | 1.10 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC4R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268796
(Ac-Nle-c[Asp-cis-4-guanidinyl-Pro-DPhe-Arg-Trp-Lys...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,12.11,21.76,wD:25.25,39.41,61.68,63.72,(20.34,-25.22,;18.98,-24.49,;18.93,-22.95,;17.57,-22.23,;17.52,-20.69,;18.83,-19.87,;18.78,-18.33,;20.08,-17.51,;17.42,-17.6,;16.16,-19.96,;16.11,-18.42,;14.85,-20.77,;13.49,-20.05,;12.18,-20.86,;12.24,-22.4,;13.59,-23.13,;10.92,-23.22,;9.56,-22.49,;8.26,-23.31,;6.89,-22.58,;5.58,-23.39,;4.23,-22.66,;4.17,-21.12,;2.82,-20.4,;1.5,-21.21,;2.76,-18.86,;1.39,-18.12,;-.07,-18.63,;-1.33,-17.73,;-2.56,-18.65,;-2.05,-20.13,;-2.79,-21.47,;-1.99,-22.78,;-.45,-22.73,;.28,-21.39,;-.52,-20.09,;4.07,-18.04,;5.39,-18.27,;6.72,-19.07,;4.02,-16.5,;2.66,-15.78,;2.61,-14.23,;1.25,-13.51,;1.2,-11.97,;-.17,-11.24,;-.21,-9.7,;-1.47,-12.06,;5.33,-15.69,;6.69,-16.41,;6.74,-17.95,;8,-15.6,;7.95,-14.06,;6.59,-13.33,;6.54,-11.79,;5.18,-11.07,;3.87,-11.88,;3.92,-13.43,;5.27,-14.15,;9.36,-16.32,;10.67,-15.52,;10.62,-13.97,;12.04,-16.25,;13.12,-15.14,;14.62,-15.54,;14.61,-17.08,;12.07,-17.77,;13.44,-18.51,;14.75,-17.69,;15.84,-14.61,;15.64,-13.08,;14.21,-12.48,;16.87,-12.14,;2.92,-23.48,;1.55,-22.75,;2.96,-25.02,)| Show InChI InChI=1S/C50H72N16O9/c1-3-4-16-35(59-28(2)67)43(70)65-39-25-41(68)56-20-11-10-18-34(42(51)69)61-46(73)38(23-30-26-58-33-17-9-8-15-32(30)33)63-44(71)36(19-12-21-57-49(52)53)62-45(72)37(22-29-13-6-5-7-14-29)64-47(74)40-24-31(60-50(54)55)27-66(40)48(39)75/h5-9,13-15,17,26,31,34-40,58H,3-4,10-12,16,18-25,27H2,1-2H3,(H2,51,69)(H,56,68)(H,59,67)(H,61,73)(H,62,72)(H,63,71)(H,64,74)(H,65,70)(H4,52,53,57)(H4,54,55,60)/t31-,34-,35-,36-,37+,38-,39-,40-/m0/s1 | PDB
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| n/a | n/a | 1.10 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC1R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268796
(Ac-Nle-c[Asp-cis-4-guanidinyl-Pro-DPhe-Arg-Trp-Lys...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,12.11,21.76,wD:25.25,39.41,61.68,63.72,(20.34,-25.22,;18.98,-24.49,;18.93,-22.95,;17.57,-22.23,;17.52,-20.69,;18.83,-19.87,;18.78,-18.33,;20.08,-17.51,;17.42,-17.6,;16.16,-19.96,;16.11,-18.42,;14.85,-20.77,;13.49,-20.05,;12.18,-20.86,;12.24,-22.4,;13.59,-23.13,;10.92,-23.22,;9.56,-22.49,;8.26,-23.31,;6.89,-22.58,;5.58,-23.39,;4.23,-22.66,;4.17,-21.12,;2.82,-20.4,;1.5,-21.21,;2.76,-18.86,;1.39,-18.12,;-.07,-18.63,;-1.33,-17.73,;-2.56,-18.65,;-2.05,-20.13,;-2.79,-21.47,;-1.99,-22.78,;-.45,-22.73,;.28,-21.39,;-.52,-20.09,;4.07,-18.04,;5.39,-18.27,;6.72,-19.07,;4.02,-16.5,;2.66,-15.78,;2.61,-14.23,;1.25,-13.51,;1.2,-11.97,;-.17,-11.24,;-.21,-9.7,;-1.47,-12.06,;5.33,-15.69,;6.69,-16.41,;6.74,-17.95,;8,-15.6,;7.95,-14.06,;6.59,-13.33,;6.54,-11.79,;5.18,-11.07,;3.87,-11.88,;3.92,-13.43,;5.27,-14.15,;9.36,-16.32,;10.67,-15.52,;10.62,-13.97,;12.04,-16.25,;13.12,-15.14,;14.62,-15.54,;14.61,-17.08,;12.07,-17.77,;13.44,-18.51,;14.75,-17.69,;15.84,-14.61,;15.64,-13.08,;14.21,-12.48,;16.87,-12.14,;2.92,-23.48,;1.55,-22.75,;2.96,-25.02,)| Show InChI InChI=1S/C50H72N16O9/c1-3-4-16-35(59-28(2)67)43(70)65-39-25-41(68)56-20-11-10-18-34(42(51)69)61-46(73)38(23-30-26-58-33-17-9-8-15-32(30)33)63-44(71)36(19-12-21-57-49(52)53)62-45(72)37(22-29-13-6-5-7-14-29)64-47(74)40-24-31(60-50(54)55)27-66(40)48(39)75/h5-9,13-15,17,26,31,34-40,58H,3-4,10-12,16,18-25,27H2,1-2H3,(H2,51,69)(H,56,68)(H,59,67)(H,61,73)(H,62,72)(H,63,71)(H,64,74)(H,65,70)(H4,52,53,57)(H4,54,55,60)/t31-,34-,35-,36-,37+,38-,39-,40-/m0/s1 | PDB
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| n/a | n/a | 1.10 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC5R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268806
(Ac-Tyr-Val-Nle-Gly-His-DPhe-Arg-Trp-Asp-Arg-Phe-Gl...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r,wU:12.21,56.58,35.35,81.85,45.46,4.4,100.104,wD:67.69,8.8,89.93,(6.82,-32.01,;5.49,-32.78,;5.49,-34.31,;4.16,-35.09,;4.16,-36.62,;2.82,-37.38,;1.49,-36.61,;1.49,-35.08,;.16,-37.38,;-1.17,-36.62,;-2.5,-37.4,;-2.5,-38.94,;-3.83,-36.63,;-3.83,-35.09,;-2.49,-34.32,;-1.16,-35.09,;.18,-34.32,;.18,-32.78,;1.51,-32,;-1.15,-32.01,;-2.49,-32.78,;-5.18,-37.37,;-6.51,-36.6,;-7.85,-37.37,;-6.51,-35.06,;.16,-38.93,;1.49,-39.69,;-1.18,-39.7,;5.49,-37.39,;5.49,-38.94,;6.83,-36.63,;8.16,-37.4,;9.49,-36.63,;9.49,-35.09,;10.83,-37.4,;12.17,-36.64,;12.17,-35.1,;13.5,-34.33,;14.91,-34.96,;15.95,-33.81,;15.17,-32.48,;13.66,-32.79,;13.5,-37.41,;13.5,-38.95,;14.83,-36.63,;16.17,-37.4,;16.17,-38.95,;17.5,-39.71,;18.84,-38.95,;20.17,-39.72,;20.17,-41.26,;18.83,-42.03,;17.5,-41.26,;17.5,-36.63,;17.5,-35.1,;18.83,-37.4,;20.18,-36.65,;20.18,-35.11,;21.51,-34.34,;21.51,-32.81,;22.84,-32.03,;22.85,-30.49,;21.51,-29.71,;24.18,-29.72,;21.51,-37.42,;21.51,-38.97,;22.84,-36.64,;24.17,-37.41,;24.17,-38.95,;25.5,-39.72,;26.91,-39.1,;27.94,-40.24,;27.17,-41.58,;27.64,-43.04,;26.61,-44.18,;25.1,-43.86,;24.63,-42.39,;25.66,-41.25,;25.5,-36.64,;25.5,-35.1,;26.84,-37.41,;28.17,-36.64,;28.17,-35.11,;29.5,-34.34,;30.83,-35.11,;29.5,-32.8,;29.5,-37.42,;29.5,-38.96,;30.84,-36.64,;32.17,-37.41,;32.17,-38.96,;33.49,-39.72,;33.49,-41.27,;34.82,-42.04,;34.83,-43.58,;33.49,-44.35,;36.16,-44.35,;33.49,-36.64,;33.49,-35.11,;34.83,-37.41,;36.16,-36.64,;36.16,-35.1,;37.5,-34.34,;38.83,-35.11,;40.16,-34.34,;40.17,-32.8,;38.84,-32.03,;37.5,-32.79,;37.5,-37.42,;37.5,-38.95,;38.83,-36.64,;40.16,-37.41,;41.48,-36.64,;42.83,-37.42,;41.48,-35.11,)| Show InChI InChI=1S/C77H104N22O16/c1-5-6-22-53(94-75(115)65(43(2)3)99-74(114)57(90-44(4)100)34-47-26-28-50(101)29-27-47)66(106)88-41-63(103)91-60(36-49-39-83-42-89-49)72(112)96-58(33-46-19-11-8-12-20-46)70(110)92-55(25-16-31-85-77(81)82)69(109)97-59(35-48-38-86-52-23-14-13-21-51(48)52)71(111)98-61(37-64(104)105)73(113)93-54(24-15-30-84-76(79)80)68(108)95-56(67(107)87-40-62(78)102)32-45-17-9-7-10-18-45/h7-14,17-21,23,26-29,38-39,42-43,53-61,65,86,101H,5-6,15-16,22,24-25,30-37,40-41H2,1-4H3,(H2,78,102)(H,83,89)(H,87,107)(H,88,106)(H,90,100)(H,91,103)(H,92,110)(H,93,113)(H,94,115)(H,95,108)(H,96,112)(H,97,109)(H,98,111)(H,99,114)(H,104,105)(H4,79,80,84)(H4,81,82,85)/t53-,54-,55-,56-,57-,58+,59-,60-,61-,65-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
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| Article
PubMed
| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC4R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268802
(Ac-Nle-c[Asp-cis-4-guanidinyl-Pro-DNal(2')-Arg-Trp...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2C[C@@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,12.11,21.81,50.52,wD:25.25,39.41,65.73,67.77,(39.57,-47.74,;38.21,-47.02,;38.16,-45.48,;36.8,-44.75,;36.75,-43.21,;38.06,-42.4,;38,-40.86,;39.31,-40.04,;36.65,-40.13,;35.39,-42.49,;35.34,-40.95,;34.08,-43.3,;32.72,-42.58,;31.42,-43.39,;31.47,-44.93,;32.83,-45.65,;30.16,-45.74,;28.8,-45.02,;27.49,-45.83,;26.13,-45.1,;24.82,-45.91,;23.47,-45.19,;23.42,-43.65,;22.06,-42.92,;20.75,-43.74,;22.01,-41.38,;20.63,-40.65,;19.18,-41.16,;17.92,-40.26,;16.69,-41.18,;17.19,-42.65,;16.46,-44,;17.25,-45.3,;18.8,-45.26,;19.52,-43.91,;18.73,-42.62,;23.31,-40.57,;24.63,-40.8,;25.96,-41.59,;23.26,-39.03,;21.9,-38.31,;21.85,-36.77,;20.5,-36.04,;20.44,-34.5,;19.08,-33.78,;19.04,-32.24,;17.77,-34.59,;24.57,-38.22,;25.93,-38.94,;25.98,-40.48,;27.24,-38.13,;27.19,-36.59,;25.83,-35.86,;24.52,-36.68,;23.17,-35.96,;23.11,-34.42,;21.76,-33.69,;21.71,-32.15,;23.02,-31.33,;24.38,-32.07,;24.43,-33.61,;25.78,-34.33,;28.59,-38.85,;29.91,-38.05,;29.86,-36.5,;31.27,-38.78,;32.35,-37.67,;33.85,-38.07,;33.84,-39.61,;31.31,-40.3,;32.67,-41.04,;33.98,-40.22,;35.07,-37.14,;34.87,-35.61,;33.45,-35.01,;36.1,-34.67,;22.16,-46,;20.8,-45.28,;22.21,-47.54,)| Show InChI InChI=1S/C54H74N16O9/c1-3-4-15-39(63-30(2)71)47(74)69-43-27-45(72)60-21-10-9-17-38(46(55)73)65-50(77)42(25-34-28-62-37-16-8-7-14-36(34)37)67-48(75)40(18-11-22-61-53(56)57)66-49(76)41(24-31-19-20-32-12-5-6-13-33(32)23-31)68-51(78)44-26-35(64-54(58)59)29-70(44)52(43)79/h5-8,12-14,16,19-20,23,28,35,38-44,62H,3-4,9-11,15,17-18,21-22,24-27,29H2,1-2H3,(H2,55,73)(H,60,72)(H,63,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,56,57,61)(H4,58,59,64)/t35-,38-,39-,40-,41+,42-,43-,44-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC1R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50184359
((3S,6S,9R,12S,15S,23S)-15-((S)-2-acetylamino-hexan...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r,wU:21.75,50.52,12.11,4.4,39.41,wD:25.25,61.64,(19.68,-11.7,;18.32,-10.97,;18.27,-9.43,;16.91,-8.71,;16.86,-7.17,;18.17,-6.36,;18.11,-4.82,;19.42,-4,;16.76,-4.09,;15.5,-6.44,;15.45,-4.9,;14.19,-7.26,;12.83,-6.53,;11.53,-7.35,;11.58,-8.88,;12.94,-9.61,;10.27,-9.7,;8.91,-8.97,;7.6,-9.79,;6.25,-9.06,;4.94,-9.87,;3.58,-9.15,;3.53,-7.61,;2.17,-6.88,;.86,-7.7,;2.12,-5.35,;.76,-4.62,;.71,-3.08,;1.93,-2.14,;1.41,-.69,;-.14,-.74,;-1.21,.35,;-2.69,-.02,;-3.1,-1.51,;-2.03,-2.6,;-.56,-2.22,;3.43,-4.53,;4.79,-5.26,;4.84,-6.8,;6.98,-5.22,;8.76,-4.36,;10.12,-5.08,;10.17,-6.62,;8.86,-7.43,;7.5,-6.71,;6.19,-7.52,;8.83,-5.93,;6.09,-4.44,;6.04,-2.9,;4.68,-2.18,;7.35,-2.09,;7.3,-.55,;5.94,.17,;5.89,1.71,;4.53,2.44,;3.23,1.62,;3.28,.07,;4.64,-.64,;8.71,-2.82,;10.02,-2,;9.96,-.46,;11.37,-2.73,;12.68,-1.91,;12.64,-.37,;13.86,.56,;13.35,2.01,;11.81,1.97,;11.37,.5,;11.42,-4.27,;12.78,-4.99,;14.09,-4.18,;2.27,-9.96,;.91,-9.24,;2.32,-11.5,)| Show InChI InChI=1S/C50H69N15O9/c1-3-4-16-36(59-29(2)66)44(69)65-41-25-42(67)55-20-11-10-18-35(43(51)68)60-47(72)39(23-31-26-57-34-17-9-8-15-33(31)34)63-45(70)37(19-12-21-56-50(52)53)61-46(71)38(22-30-13-6-5-7-14-30)62-48(73)40(64-49(41)74)24-32-27-54-28-58-32/h5-9,13-15,17,26-28,35-41,57H,3-4,10-12,16,18-25H2,1-2H3,(H2,51,68)(H,54,58)(H,55,67)(H,59,66)(H,60,72)(H,61,71)(H,62,73)(H,63,70)(H,64,74)(H,65,69)(H4,52,53,56)/t35-,36-,37-,38+,39-,40-,41-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.30 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC3R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268801
(Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DNal(2')-Arg-T...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,12.11,67.77,21.81,50.52,wD:25.25,39.41,65.73,(14,-47.54,;12.64,-46.82,;12.59,-45.28,;11.23,-44.55,;11.18,-43.02,;12.48,-42.2,;12.43,-40.66,;13.74,-39.85,;11.08,-39.94,;9.82,-42.29,;9.77,-40.75,;8.51,-43.1,;7.15,-42.38,;5.85,-43.19,;5.9,-44.73,;7.25,-45.46,;4.58,-45.55,;3.23,-44.82,;1.92,-45.64,;.56,-44.9,;-.75,-45.72,;-2.1,-44.99,;-2.16,-43.45,;-3.51,-42.73,;-4.83,-43.54,;-3.56,-41.19,;-4.94,-40.46,;-6.39,-40.96,;-7.65,-40.07,;-8.88,-40.99,;-8.38,-42.46,;-9.11,-43.8,;-8.32,-45.1,;-6.78,-45.06,;-6.05,-43.72,;-6.84,-42.42,;-2.26,-40.37,;-.94,-40.6,;.38,-41.4,;-2.31,-38.83,;-3.67,-38.11,;-3.72,-36.57,;-5.08,-35.85,;-5.13,-34.31,;-6.49,-33.58,;-6.54,-32.04,;-7.8,-34.4,;-1,-38.02,;.36,-38.75,;.41,-40.29,;1.67,-37.93,;1.61,-36.39,;.26,-35.67,;-1.06,-36.48,;-2.41,-35.77,;-2.46,-34.22,;-3.82,-33.49,;-3.87,-31.96,;-2.55,-31.14,;-1.19,-31.87,;-1.15,-33.41,;.21,-34.13,;3.02,-38.66,;4.34,-37.85,;4.28,-36.3,;5.7,-38.58,;6.78,-37.48,;8.27,-37.87,;8.27,-39.41,;5.74,-40.1,;7.1,-40.84,;8.41,-40.03,;9.5,-36.94,;9.3,-35.41,;7.88,-34.82,;10.52,-34.48,;-3.41,-45.81,;-4.77,-45.08,;-3.37,-47.35,)| Show InChI InChI=1S/C54H74N16O9/c1-3-4-15-39(63-30(2)71)47(74)69-43-27-45(72)60-21-10-9-17-38(46(55)73)65-50(77)42(25-34-28-62-37-16-8-7-14-36(34)37)67-48(75)40(18-11-22-61-53(56)57)66-49(76)41(24-31-19-20-32-12-5-6-13-33(32)23-31)68-51(78)44-26-35(64-54(58)59)29-70(44)52(43)79/h5-8,12-14,16,19-20,23,28,35,38-44,62H,3-4,9-11,15,17-18,21-22,24-27,29H2,1-2H3,(H2,55,73)(H,60,72)(H,63,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,56,57,61)(H4,58,59,64)/t35-,38+,39+,40+,41-,42+,43+,44+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC4R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268806
(Ac-Tyr-Val-Nle-Gly-His-DPhe-Arg-Trp-Asp-Arg-Phe-Gl...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r,wU:12.21,56.58,35.35,81.85,45.46,4.4,100.104,wD:67.69,8.8,89.93,(6.82,-32.01,;5.49,-32.78,;5.49,-34.31,;4.16,-35.09,;4.16,-36.62,;2.82,-37.38,;1.49,-36.61,;1.49,-35.08,;.16,-37.38,;-1.17,-36.62,;-2.5,-37.4,;-2.5,-38.94,;-3.83,-36.63,;-3.83,-35.09,;-2.49,-34.32,;-1.16,-35.09,;.18,-34.32,;.18,-32.78,;1.51,-32,;-1.15,-32.01,;-2.49,-32.78,;-5.18,-37.37,;-6.51,-36.6,;-7.85,-37.37,;-6.51,-35.06,;.16,-38.93,;1.49,-39.69,;-1.18,-39.7,;5.49,-37.39,;5.49,-38.94,;6.83,-36.63,;8.16,-37.4,;9.49,-36.63,;9.49,-35.09,;10.83,-37.4,;12.17,-36.64,;12.17,-35.1,;13.5,-34.33,;14.91,-34.96,;15.95,-33.81,;15.17,-32.48,;13.66,-32.79,;13.5,-37.41,;13.5,-38.95,;14.83,-36.63,;16.17,-37.4,;16.17,-38.95,;17.5,-39.71,;18.84,-38.95,;20.17,-39.72,;20.17,-41.26,;18.83,-42.03,;17.5,-41.26,;17.5,-36.63,;17.5,-35.1,;18.83,-37.4,;20.18,-36.65,;20.18,-35.11,;21.51,-34.34,;21.51,-32.81,;22.84,-32.03,;22.85,-30.49,;21.51,-29.71,;24.18,-29.72,;21.51,-37.42,;21.51,-38.97,;22.84,-36.64,;24.17,-37.41,;24.17,-38.95,;25.5,-39.72,;26.91,-39.1,;27.94,-40.24,;27.17,-41.58,;27.64,-43.04,;26.61,-44.18,;25.1,-43.86,;24.63,-42.39,;25.66,-41.25,;25.5,-36.64,;25.5,-35.1,;26.84,-37.41,;28.17,-36.64,;28.17,-35.11,;29.5,-34.34,;30.83,-35.11,;29.5,-32.8,;29.5,-37.42,;29.5,-38.96,;30.84,-36.64,;32.17,-37.41,;32.17,-38.96,;33.49,-39.72,;33.49,-41.27,;34.82,-42.04,;34.83,-43.58,;33.49,-44.35,;36.16,-44.35,;33.49,-36.64,;33.49,-35.11,;34.83,-37.41,;36.16,-36.64,;36.16,-35.1,;37.5,-34.34,;38.83,-35.11,;40.16,-34.34,;40.17,-32.8,;38.84,-32.03,;37.5,-32.79,;37.5,-37.42,;37.5,-38.95,;38.83,-36.64,;40.16,-37.41,;41.48,-36.64,;42.83,-37.42,;41.48,-35.11,)| Show InChI InChI=1S/C77H104N22O16/c1-5-6-22-53(94-75(115)65(43(2)3)99-74(114)57(90-44(4)100)34-47-26-28-50(101)29-27-47)66(106)88-41-63(103)91-60(36-49-39-83-42-89-49)72(112)96-58(33-46-19-11-8-12-20-46)70(110)92-55(25-16-31-85-77(81)82)69(109)97-59(35-48-38-86-52-23-14-13-21-51(48)52)71(111)98-61(37-64(104)105)73(113)93-54(24-15-30-84-76(79)80)68(108)95-56(67(107)87-40-62(78)102)32-45-17-9-7-10-18-45/h7-14,17-21,23,26-29,38-39,42-43,53-61,65,86,101H,5-6,15-16,22,24-25,30-37,40-41H2,1-4H3,(H2,78,102)(H,83,89)(H,87,107)(H,88,106)(H,90,100)(H,91,103)(H,92,110)(H,93,113)(H,94,115)(H,95,108)(H,96,112)(H,97,109)(H,98,111)(H,99,114)(H,104,105)(H4,79,80,84)(H4,81,82,85)/t53-,54-,55-,56-,57-,58+,59-,60-,61-,65-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC3R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268802
(Ac-Nle-c[Asp-cis-4-guanidinyl-Pro-DNal(2')-Arg-Trp...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2C[C@@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,12.11,21.81,50.52,wD:25.25,39.41,65.73,67.77,(39.57,-47.74,;38.21,-47.02,;38.16,-45.48,;36.8,-44.75,;36.75,-43.21,;38.06,-42.4,;38,-40.86,;39.31,-40.04,;36.65,-40.13,;35.39,-42.49,;35.34,-40.95,;34.08,-43.3,;32.72,-42.58,;31.42,-43.39,;31.47,-44.93,;32.83,-45.65,;30.16,-45.74,;28.8,-45.02,;27.49,-45.83,;26.13,-45.1,;24.82,-45.91,;23.47,-45.19,;23.42,-43.65,;22.06,-42.92,;20.75,-43.74,;22.01,-41.38,;20.63,-40.65,;19.18,-41.16,;17.92,-40.26,;16.69,-41.18,;17.19,-42.65,;16.46,-44,;17.25,-45.3,;18.8,-45.26,;19.52,-43.91,;18.73,-42.62,;23.31,-40.57,;24.63,-40.8,;25.96,-41.59,;23.26,-39.03,;21.9,-38.31,;21.85,-36.77,;20.5,-36.04,;20.44,-34.5,;19.08,-33.78,;19.04,-32.24,;17.77,-34.59,;24.57,-38.22,;25.93,-38.94,;25.98,-40.48,;27.24,-38.13,;27.19,-36.59,;25.83,-35.86,;24.52,-36.68,;23.17,-35.96,;23.11,-34.42,;21.76,-33.69,;21.71,-32.15,;23.02,-31.33,;24.38,-32.07,;24.43,-33.61,;25.78,-34.33,;28.59,-38.85,;29.91,-38.05,;29.86,-36.5,;31.27,-38.78,;32.35,-37.67,;33.85,-38.07,;33.84,-39.61,;31.31,-40.3,;32.67,-41.04,;33.98,-40.22,;35.07,-37.14,;34.87,-35.61,;33.45,-35.01,;36.1,-34.67,;22.16,-46,;20.8,-45.28,;22.21,-47.54,)| Show InChI InChI=1S/C54H74N16O9/c1-3-4-15-39(63-30(2)71)47(74)69-43-27-45(72)60-21-10-9-17-38(46(55)73)65-50(77)42(25-34-28-62-37-16-8-7-14-36(34)37)67-48(75)40(18-11-22-61-53(56)57)66-49(76)41(24-31-19-20-32-12-5-6-13-33(32)23-31)68-51(78)44-26-35(64-54(58)59)29-70(44)52(43)79/h5-8,12-14,16,19-20,23,28,35,38-44,62H,3-4,9-11,15,17-18,21-22,24-27,29H2,1-2H3,(H2,55,73)(H,60,72)(H,63,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,56,57,61)(H4,58,59,64)/t35-,38-,39-,40-,41+,42-,43-,44-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.20 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC5R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268802
(Ac-Nle-c[Asp-cis-4-guanidinyl-Pro-DNal(2')-Arg-Trp...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2C[C@@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,12.11,21.81,50.52,wD:25.25,39.41,65.73,67.77,(39.57,-47.74,;38.21,-47.02,;38.16,-45.48,;36.8,-44.75,;36.75,-43.21,;38.06,-42.4,;38,-40.86,;39.31,-40.04,;36.65,-40.13,;35.39,-42.49,;35.34,-40.95,;34.08,-43.3,;32.72,-42.58,;31.42,-43.39,;31.47,-44.93,;32.83,-45.65,;30.16,-45.74,;28.8,-45.02,;27.49,-45.83,;26.13,-45.1,;24.82,-45.91,;23.47,-45.19,;23.42,-43.65,;22.06,-42.92,;20.75,-43.74,;22.01,-41.38,;20.63,-40.65,;19.18,-41.16,;17.92,-40.26,;16.69,-41.18,;17.19,-42.65,;16.46,-44,;17.25,-45.3,;18.8,-45.26,;19.52,-43.91,;18.73,-42.62,;23.31,-40.57,;24.63,-40.8,;25.96,-41.59,;23.26,-39.03,;21.9,-38.31,;21.85,-36.77,;20.5,-36.04,;20.44,-34.5,;19.08,-33.78,;19.04,-32.24,;17.77,-34.59,;24.57,-38.22,;25.93,-38.94,;25.98,-40.48,;27.24,-38.13,;27.19,-36.59,;25.83,-35.86,;24.52,-36.68,;23.17,-35.96,;23.11,-34.42,;21.76,-33.69,;21.71,-32.15,;23.02,-31.33,;24.38,-32.07,;24.43,-33.61,;25.78,-34.33,;28.59,-38.85,;29.91,-38.05,;29.86,-36.5,;31.27,-38.78,;32.35,-37.67,;33.85,-38.07,;33.84,-39.61,;31.31,-40.3,;32.67,-41.04,;33.98,-40.22,;35.07,-37.14,;34.87,-35.61,;33.45,-35.01,;36.1,-34.67,;22.16,-46,;20.8,-45.28,;22.21,-47.54,)| Show InChI InChI=1S/C54H74N16O9/c1-3-4-15-39(63-30(2)71)47(74)69-43-27-45(72)60-21-10-9-17-38(46(55)73)65-50(77)42(25-34-28-62-37-16-8-7-14-36(34)37)67-48(75)40(18-11-22-61-53(56)57)66-49(76)41(24-31-19-20-32-12-5-6-13-33(32)23-31)68-51(78)44-26-35(64-54(58)59)29-70(44)52(43)79/h5-8,12-14,16,19-20,23,28,35,38-44,62H,3-4,9-11,15,17-18,21-22,24-27,29H2,1-2H3,(H2,55,73)(H,60,72)(H,63,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,56,57,61)(H4,58,59,64)/t35-,38-,39-,40-,41+,42-,43-,44-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.20 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC3R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268801
(Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DNal(2')-Arg-T...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,12.11,67.77,21.81,50.52,wD:25.25,39.41,65.73,(14,-47.54,;12.64,-46.82,;12.59,-45.28,;11.23,-44.55,;11.18,-43.02,;12.48,-42.2,;12.43,-40.66,;13.74,-39.85,;11.08,-39.94,;9.82,-42.29,;9.77,-40.75,;8.51,-43.1,;7.15,-42.38,;5.85,-43.19,;5.9,-44.73,;7.25,-45.46,;4.58,-45.55,;3.23,-44.82,;1.92,-45.64,;.56,-44.9,;-.75,-45.72,;-2.1,-44.99,;-2.16,-43.45,;-3.51,-42.73,;-4.83,-43.54,;-3.56,-41.19,;-4.94,-40.46,;-6.39,-40.96,;-7.65,-40.07,;-8.88,-40.99,;-8.38,-42.46,;-9.11,-43.8,;-8.32,-45.1,;-6.78,-45.06,;-6.05,-43.72,;-6.84,-42.42,;-2.26,-40.37,;-.94,-40.6,;.38,-41.4,;-2.31,-38.83,;-3.67,-38.11,;-3.72,-36.57,;-5.08,-35.85,;-5.13,-34.31,;-6.49,-33.58,;-6.54,-32.04,;-7.8,-34.4,;-1,-38.02,;.36,-38.75,;.41,-40.29,;1.67,-37.93,;1.61,-36.39,;.26,-35.67,;-1.06,-36.48,;-2.41,-35.77,;-2.46,-34.22,;-3.82,-33.49,;-3.87,-31.96,;-2.55,-31.14,;-1.19,-31.87,;-1.15,-33.41,;.21,-34.13,;3.02,-38.66,;4.34,-37.85,;4.28,-36.3,;5.7,-38.58,;6.78,-37.48,;8.27,-37.87,;8.27,-39.41,;5.74,-40.1,;7.1,-40.84,;8.41,-40.03,;9.5,-36.94,;9.3,-35.41,;7.88,-34.82,;10.52,-34.48,;-3.41,-45.81,;-4.77,-45.08,;-3.37,-47.35,)| Show InChI InChI=1S/C54H74N16O9/c1-3-4-15-39(63-30(2)71)47(74)69-43-27-45(72)60-21-10-9-17-38(46(55)73)65-50(77)42(25-34-28-62-37-16-8-7-14-36(34)37)67-48(75)40(18-11-22-61-53(56)57)66-49(76)41(24-31-19-20-32-12-5-6-13-33(32)23-31)68-51(78)44-26-35(64-54(58)59)29-70(44)52(43)79/h5-8,12-14,16,19-20,23,28,35,38-44,62H,3-4,9-11,15,17-18,21-22,24-27,29H2,1-2H3,(H2,55,73)(H,60,72)(H,63,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,56,57,61)(H4,58,59,64)/t35-,38+,39+,40+,41-,42+,43+,44+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.30 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268801
(Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DNal(2')-Arg-T...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,12.11,67.77,21.81,50.52,wD:25.25,39.41,65.73,(14,-47.54,;12.64,-46.82,;12.59,-45.28,;11.23,-44.55,;11.18,-43.02,;12.48,-42.2,;12.43,-40.66,;13.74,-39.85,;11.08,-39.94,;9.82,-42.29,;9.77,-40.75,;8.51,-43.1,;7.15,-42.38,;5.85,-43.19,;5.9,-44.73,;7.25,-45.46,;4.58,-45.55,;3.23,-44.82,;1.92,-45.64,;.56,-44.9,;-.75,-45.72,;-2.1,-44.99,;-2.16,-43.45,;-3.51,-42.73,;-4.83,-43.54,;-3.56,-41.19,;-4.94,-40.46,;-6.39,-40.96,;-7.65,-40.07,;-8.88,-40.99,;-8.38,-42.46,;-9.11,-43.8,;-8.32,-45.1,;-6.78,-45.06,;-6.05,-43.72,;-6.84,-42.42,;-2.26,-40.37,;-.94,-40.6,;.38,-41.4,;-2.31,-38.83,;-3.67,-38.11,;-3.72,-36.57,;-5.08,-35.85,;-5.13,-34.31,;-6.49,-33.58,;-6.54,-32.04,;-7.8,-34.4,;-1,-38.02,;.36,-38.75,;.41,-40.29,;1.67,-37.93,;1.61,-36.39,;.26,-35.67,;-1.06,-36.48,;-2.41,-35.77,;-2.46,-34.22,;-3.82,-33.49,;-3.87,-31.96,;-2.55,-31.14,;-1.19,-31.87,;-1.15,-33.41,;.21,-34.13,;3.02,-38.66,;4.34,-37.85,;4.28,-36.3,;5.7,-38.58,;6.78,-37.48,;8.27,-37.87,;8.27,-39.41,;5.74,-40.1,;7.1,-40.84,;8.41,-40.03,;9.5,-36.94,;9.3,-35.41,;7.88,-34.82,;10.52,-34.48,;-3.41,-45.81,;-4.77,-45.08,;-3.37,-47.35,)| Show InChI InChI=1S/C54H74N16O9/c1-3-4-15-39(63-30(2)71)47(74)69-43-27-45(72)60-21-10-9-17-38(46(55)73)65-50(77)42(25-34-28-62-37-16-8-7-14-36(34)37)67-48(75)40(18-11-22-61-53(56)57)66-49(76)41(24-31-19-20-32-12-5-6-13-33(32)23-31)68-51(78)44-26-35(64-54(58)59)29-70(44)52(43)79/h5-8,12-14,16,19-20,23,28,35,38-44,62H,3-4,9-11,15,17-18,21-22,24-27,29H2,1-2H3,(H2,55,73)(H,60,72)(H,63,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,56,57,61)(H4,58,59,64)/t35-,38+,39+,40+,41-,42+,43+,44+/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.30 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC3R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50121268
(21-(2-Acetylamino-hexanoylamino)-7-[3-(diaminometh...)Show SMILES CCCC[C@@H](NC(C)=O)C(=O)N[C@@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O Show InChI InChI=1S/C54H71N15O9/c1-3-4-15-40(63-31(2)70)48(73)69-45-27-46(71)59-21-10-9-17-39(47(55)72)64-51(76)43(25-35-28-61-38-16-8-7-14-37(35)38)67-49(74)41(18-11-22-60-54(56)57)65-50(75)42(24-32-19-20-33-12-5-6-13-34(33)23-32)66-52(77)44(68-53(45)78)26-36-29-58-30-62-36/h5-8,12-14,16,19-20,23,28-30,39-45,61H,3-4,9-11,15,17-18,21-22,24-27H2,1-2H3,(H2,55,72)(H,58,62)(H,59,71)(H,63,70)(H,64,76)(H,65,75)(H,66,77)(H,67,74)(H,68,78)(H,69,73)(H4,56,57,60)/t39-,40+,41-,42+,43-,44-,45+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
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| CHEMBL
PC cid
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UniChem
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PubMed
| n/a | n/a | 2.30 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC3R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268806
(Ac-Tyr-Val-Nle-Gly-His-DPhe-Arg-Trp-Asp-Arg-Phe-Gl...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r,wU:12.21,56.58,35.35,81.85,45.46,4.4,100.104,wD:67.69,8.8,89.93,(6.82,-32.01,;5.49,-32.78,;5.49,-34.31,;4.16,-35.09,;4.16,-36.62,;2.82,-37.38,;1.49,-36.61,;1.49,-35.08,;.16,-37.38,;-1.17,-36.62,;-2.5,-37.4,;-2.5,-38.94,;-3.83,-36.63,;-3.83,-35.09,;-2.49,-34.32,;-1.16,-35.09,;.18,-34.32,;.18,-32.78,;1.51,-32,;-1.15,-32.01,;-2.49,-32.78,;-5.18,-37.37,;-6.51,-36.6,;-7.85,-37.37,;-6.51,-35.06,;.16,-38.93,;1.49,-39.69,;-1.18,-39.7,;5.49,-37.39,;5.49,-38.94,;6.83,-36.63,;8.16,-37.4,;9.49,-36.63,;9.49,-35.09,;10.83,-37.4,;12.17,-36.64,;12.17,-35.1,;13.5,-34.33,;14.91,-34.96,;15.95,-33.81,;15.17,-32.48,;13.66,-32.79,;13.5,-37.41,;13.5,-38.95,;14.83,-36.63,;16.17,-37.4,;16.17,-38.95,;17.5,-39.71,;18.84,-38.95,;20.17,-39.72,;20.17,-41.26,;18.83,-42.03,;17.5,-41.26,;17.5,-36.63,;17.5,-35.1,;18.83,-37.4,;20.18,-36.65,;20.18,-35.11,;21.51,-34.34,;21.51,-32.81,;22.84,-32.03,;22.85,-30.49,;21.51,-29.71,;24.18,-29.72,;21.51,-37.42,;21.51,-38.97,;22.84,-36.64,;24.17,-37.41,;24.17,-38.95,;25.5,-39.72,;26.91,-39.1,;27.94,-40.24,;27.17,-41.58,;27.64,-43.04,;26.61,-44.18,;25.1,-43.86,;24.63,-42.39,;25.66,-41.25,;25.5,-36.64,;25.5,-35.1,;26.84,-37.41,;28.17,-36.64,;28.17,-35.11,;29.5,-34.34,;30.83,-35.11,;29.5,-32.8,;29.5,-37.42,;29.5,-38.96,;30.84,-36.64,;32.17,-37.41,;32.17,-38.96,;33.49,-39.72,;33.49,-41.27,;34.82,-42.04,;34.83,-43.58,;33.49,-44.35,;36.16,-44.35,;33.49,-36.64,;33.49,-35.11,;34.83,-37.41,;36.16,-36.64,;36.16,-35.1,;37.5,-34.34,;38.83,-35.11,;40.16,-34.34,;40.17,-32.8,;38.84,-32.03,;37.5,-32.79,;37.5,-37.42,;37.5,-38.95,;38.83,-36.64,;40.16,-37.41,;41.48,-36.64,;42.83,-37.42,;41.48,-35.11,)| Show InChI InChI=1S/C77H104N22O16/c1-5-6-22-53(94-75(115)65(43(2)3)99-74(114)57(90-44(4)100)34-47-26-28-50(101)29-27-47)66(106)88-41-63(103)91-60(36-49-39-83-42-89-49)72(112)96-58(33-46-19-11-8-12-20-46)70(110)92-55(25-16-31-85-77(81)82)69(109)97-59(35-48-38-86-52-23-14-13-21-51(48)52)71(111)98-61(37-64(104)105)73(113)93-54(24-15-30-84-76(79)80)68(108)95-56(67(107)87-40-62(78)102)32-45-17-9-7-10-18-45/h7-14,17-21,23,26-29,38-39,42-43,53-61,65,86,101H,5-6,15-16,22,24-25,30-37,40-41H2,1-4H3,(H2,78,102)(H,83,89)(H,87,107)(H,88,106)(H,90,100)(H,91,103)(H,92,110)(H,93,113)(H,94,115)(H,95,108)(H,96,112)(H,97,109)(H,98,111)(H,99,114)(H,104,105)(H4,79,80,84)(H4,81,82,85)/t53-,54-,55-,56-,57-,58+,59-,60-,61-,65-/m0/s1 | PDB
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PubMed
| n/a | n/a | 2.40 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC5R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268795
(Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DPhe-Arg-Trp-L...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,63.72,12.11,21.76,wD:25.25,39.41,61.68,(21.05,-10.24,;19.69,-9.52,;19.64,-7.97,;18.28,-7.25,;18.23,-5.71,;19.54,-4.89,;19.48,-3.35,;20.79,-2.54,;18.13,-2.63,;16.87,-4.98,;16.82,-3.44,;15.56,-5.8,;14.2,-5.07,;12.89,-5.89,;12.94,-7.43,;14.3,-8.15,;11.63,-8.24,;10.27,-7.52,;8.96,-8.33,;7.6,-7.6,;6.29,-8.41,;4.93,-7.69,;4.88,-6.15,;3.52,-5.42,;2.21,-6.24,;3.47,-3.88,;2.1,-3.15,;.64,-3.65,;-.62,-2.76,;-1.85,-3.68,;-1.35,-5.15,;-2.08,-6.49,;-1.28,-7.8,;.26,-7.76,;.99,-6.41,;.19,-5.12,;4.78,-3.07,;6.1,-3.3,;7.43,-4.09,;4.73,-1.52,;3.37,-.8,;3.32,.74,;1.96,1.47,;1.91,3.01,;.54,3.73,;.5,5.28,;-.76,2.92,;6.03,-.71,;7.4,-1.43,;7.45,-2.98,;8.71,-.62,;8.66,.92,;7.3,1.65,;7.25,3.18,;5.89,3.91,;4.58,3.1,;4.63,1.55,;5.98,.83,;10.06,-1.35,;11.38,-.54,;11.33,1.01,;12.75,-1.27,;13.83,-.17,;15.32,-.56,;15.32,-2.1,;12.78,-2.79,;14.15,-3.53,;15.45,-2.72,;16.54,.37,;16.34,1.9,;14.92,2.5,;17.57,2.84,;3.63,-8.5,;2.26,-7.78,;3.67,-10.04,)| Show InChI InChI=1S/C50H72N16O9/c1-3-4-16-35(59-28(2)67)43(70)65-39-25-41(68)56-20-11-10-18-34(42(51)69)61-46(73)38(23-30-26-58-33-17-9-8-15-32(30)33)63-44(71)36(19-12-21-57-49(52)53)62-45(72)37(22-29-13-6-5-7-14-29)64-47(74)40-24-31(60-50(54)55)27-66(40)48(39)75/h5-9,13-15,17,26,31,34-40,58H,3-4,10-12,16,18-25,27H2,1-2H3,(H2,51,69)(H,56,68)(H,59,67)(H,61,73)(H,62,72)(H,63,71)(H,64,74)(H,65,70)(H4,52,53,57)(H4,54,55,60)/t31-,34+,35+,36+,37-,38+,39+,40+/m1/s1 | PDB
UniProtKB/SwissProt
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PubMed
| n/a | n/a | 2.5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC5R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268802
(Ac-Nle-c[Asp-cis-4-guanidinyl-Pro-DNal(2')-Arg-Trp...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2C[C@@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,12.11,21.81,50.52,wD:25.25,39.41,65.73,67.77,(39.57,-47.74,;38.21,-47.02,;38.16,-45.48,;36.8,-44.75,;36.75,-43.21,;38.06,-42.4,;38,-40.86,;39.31,-40.04,;36.65,-40.13,;35.39,-42.49,;35.34,-40.95,;34.08,-43.3,;32.72,-42.58,;31.42,-43.39,;31.47,-44.93,;32.83,-45.65,;30.16,-45.74,;28.8,-45.02,;27.49,-45.83,;26.13,-45.1,;24.82,-45.91,;23.47,-45.19,;23.42,-43.65,;22.06,-42.92,;20.75,-43.74,;22.01,-41.38,;20.63,-40.65,;19.18,-41.16,;17.92,-40.26,;16.69,-41.18,;17.19,-42.65,;16.46,-44,;17.25,-45.3,;18.8,-45.26,;19.52,-43.91,;18.73,-42.62,;23.31,-40.57,;24.63,-40.8,;25.96,-41.59,;23.26,-39.03,;21.9,-38.31,;21.85,-36.77,;20.5,-36.04,;20.44,-34.5,;19.08,-33.78,;19.04,-32.24,;17.77,-34.59,;24.57,-38.22,;25.93,-38.94,;25.98,-40.48,;27.24,-38.13,;27.19,-36.59,;25.83,-35.86,;24.52,-36.68,;23.17,-35.96,;23.11,-34.42,;21.76,-33.69,;21.71,-32.15,;23.02,-31.33,;24.38,-32.07,;24.43,-33.61,;25.78,-34.33,;28.59,-38.85,;29.91,-38.05,;29.86,-36.5,;31.27,-38.78,;32.35,-37.67,;33.85,-38.07,;33.84,-39.61,;31.31,-40.3,;32.67,-41.04,;33.98,-40.22,;35.07,-37.14,;34.87,-35.61,;33.45,-35.01,;36.1,-34.67,;22.16,-46,;20.8,-45.28,;22.21,-47.54,)| Show InChI InChI=1S/C54H74N16O9/c1-3-4-15-39(63-30(2)71)47(74)69-43-27-45(72)60-21-10-9-17-38(46(55)73)65-50(77)42(25-34-28-62-37-16-8-7-14-36(34)37)67-48(75)40(18-11-22-61-53(56)57)66-49(76)41(24-31-19-20-32-12-5-6-13-33(32)23-31)68-51(78)44-26-35(64-54(58)59)29-70(44)52(43)79/h5-8,12-14,16,19-20,23,28,35,38-44,62H,3-4,9-11,15,17-18,21-22,24-27,29H2,1-2H3,(H2,55,73)(H,60,72)(H,63,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,56,57,61)(H4,58,59,64)/t35-,38-,39-,40-,41+,42-,43-,44-/m0/s1 | PDB
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PC cid
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| Article
PubMed
| n/a | n/a | 2.5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC4R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268795
(Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DPhe-Arg-Trp-L...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,63.72,12.11,21.76,wD:25.25,39.41,61.68,(21.05,-10.24,;19.69,-9.52,;19.64,-7.97,;18.28,-7.25,;18.23,-5.71,;19.54,-4.89,;19.48,-3.35,;20.79,-2.54,;18.13,-2.63,;16.87,-4.98,;16.82,-3.44,;15.56,-5.8,;14.2,-5.07,;12.89,-5.89,;12.94,-7.43,;14.3,-8.15,;11.63,-8.24,;10.27,-7.52,;8.96,-8.33,;7.6,-7.6,;6.29,-8.41,;4.93,-7.69,;4.88,-6.15,;3.52,-5.42,;2.21,-6.24,;3.47,-3.88,;2.1,-3.15,;.64,-3.65,;-.62,-2.76,;-1.85,-3.68,;-1.35,-5.15,;-2.08,-6.49,;-1.28,-7.8,;.26,-7.76,;.99,-6.41,;.19,-5.12,;4.78,-3.07,;6.1,-3.3,;7.43,-4.09,;4.73,-1.52,;3.37,-.8,;3.32,.74,;1.96,1.47,;1.91,3.01,;.54,3.73,;.5,5.28,;-.76,2.92,;6.03,-.71,;7.4,-1.43,;7.45,-2.98,;8.71,-.62,;8.66,.92,;7.3,1.65,;7.25,3.18,;5.89,3.91,;4.58,3.1,;4.63,1.55,;5.98,.83,;10.06,-1.35,;11.38,-.54,;11.33,1.01,;12.75,-1.27,;13.83,-.17,;15.32,-.56,;15.32,-2.1,;12.78,-2.79,;14.15,-3.53,;15.45,-2.72,;16.54,.37,;16.34,1.9,;14.92,2.5,;17.57,2.84,;3.63,-8.5,;2.26,-7.78,;3.67,-10.04,)| Show InChI InChI=1S/C50H72N16O9/c1-3-4-16-35(59-28(2)67)43(70)65-39-25-41(68)56-20-11-10-18-34(42(51)69)61-46(73)38(23-30-26-58-33-17-9-8-15-32(30)33)63-44(71)36(19-12-21-57-49(52)53)62-45(72)37(22-29-13-6-5-7-14-29)64-47(74)40-24-31(60-50(54)55)27-66(40)48(39)75/h5-9,13-15,17,26,31,34-40,58H,3-4,10-12,16,18-25,27H2,1-2H3,(H2,51,69)(H,56,68)(H,59,67)(H,61,73)(H,62,72)(H,63,71)(H,64,74)(H,65,70)(H4,52,53,57)(H4,54,55,60)/t31-,34+,35+,36+,37-,38+,39+,40+/m1/s1 | PDB
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PubMed
| n/a | n/a | 2.70 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268796
(Ac-Nle-c[Asp-cis-4-guanidinyl-Pro-DPhe-Arg-Trp-Lys...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,12.11,21.76,wD:25.25,39.41,61.68,63.72,(20.34,-25.22,;18.98,-24.49,;18.93,-22.95,;17.57,-22.23,;17.52,-20.69,;18.83,-19.87,;18.78,-18.33,;20.08,-17.51,;17.42,-17.6,;16.16,-19.96,;16.11,-18.42,;14.85,-20.77,;13.49,-20.05,;12.18,-20.86,;12.24,-22.4,;13.59,-23.13,;10.92,-23.22,;9.56,-22.49,;8.26,-23.31,;6.89,-22.58,;5.58,-23.39,;4.23,-22.66,;4.17,-21.12,;2.82,-20.4,;1.5,-21.21,;2.76,-18.86,;1.39,-18.12,;-.07,-18.63,;-1.33,-17.73,;-2.56,-18.65,;-2.05,-20.13,;-2.79,-21.47,;-1.99,-22.78,;-.45,-22.73,;.28,-21.39,;-.52,-20.09,;4.07,-18.04,;5.39,-18.27,;6.72,-19.07,;4.02,-16.5,;2.66,-15.78,;2.61,-14.23,;1.25,-13.51,;1.2,-11.97,;-.17,-11.24,;-.21,-9.7,;-1.47,-12.06,;5.33,-15.69,;6.69,-16.41,;6.74,-17.95,;8,-15.6,;7.95,-14.06,;6.59,-13.33,;6.54,-11.79,;5.18,-11.07,;3.87,-11.88,;3.92,-13.43,;5.27,-14.15,;9.36,-16.32,;10.67,-15.52,;10.62,-13.97,;12.04,-16.25,;13.12,-15.14,;14.62,-15.54,;14.61,-17.08,;12.07,-17.77,;13.44,-18.51,;14.75,-17.69,;15.84,-14.61,;15.64,-13.08,;14.21,-12.48,;16.87,-12.14,;2.92,-23.48,;1.55,-22.75,;2.96,-25.02,)| Show InChI InChI=1S/C50H72N16O9/c1-3-4-16-35(59-28(2)67)43(70)65-39-25-41(68)56-20-11-10-18-34(42(51)69)61-46(73)38(23-30-26-58-33-17-9-8-15-32(30)33)63-44(71)36(19-12-21-57-49(52)53)62-45(72)37(22-29-13-6-5-7-14-29)64-47(74)40-24-31(60-50(54)55)27-66(40)48(39)75/h5-9,13-15,17,26,31,34-40,58H,3-4,10-12,16,18-25,27H2,1-2H3,(H2,51,69)(H,56,68)(H,59,67)(H,61,73)(H,62,72)(H,63,71)(H,64,74)(H,65,70)(H4,52,53,57)(H4,54,55,60)/t31-,34-,35-,36-,37+,38-,39-,40-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 2.80 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC3R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268796
(Ac-Nle-c[Asp-cis-4-guanidinyl-Pro-DPhe-Arg-Trp-Lys...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,12.11,21.76,wD:25.25,39.41,61.68,63.72,(20.34,-25.22,;18.98,-24.49,;18.93,-22.95,;17.57,-22.23,;17.52,-20.69,;18.83,-19.87,;18.78,-18.33,;20.08,-17.51,;17.42,-17.6,;16.16,-19.96,;16.11,-18.42,;14.85,-20.77,;13.49,-20.05,;12.18,-20.86,;12.24,-22.4,;13.59,-23.13,;10.92,-23.22,;9.56,-22.49,;8.26,-23.31,;6.89,-22.58,;5.58,-23.39,;4.23,-22.66,;4.17,-21.12,;2.82,-20.4,;1.5,-21.21,;2.76,-18.86,;1.39,-18.12,;-.07,-18.63,;-1.33,-17.73,;-2.56,-18.65,;-2.05,-20.13,;-2.79,-21.47,;-1.99,-22.78,;-.45,-22.73,;.28,-21.39,;-.52,-20.09,;4.07,-18.04,;5.39,-18.27,;6.72,-19.07,;4.02,-16.5,;2.66,-15.78,;2.61,-14.23,;1.25,-13.51,;1.2,-11.97,;-.17,-11.24,;-.21,-9.7,;-1.47,-12.06,;5.33,-15.69,;6.69,-16.41,;6.74,-17.95,;8,-15.6,;7.95,-14.06,;6.59,-13.33,;6.54,-11.79,;5.18,-11.07,;3.87,-11.88,;3.92,-13.43,;5.27,-14.15,;9.36,-16.32,;10.67,-15.52,;10.62,-13.97,;12.04,-16.25,;13.12,-15.14,;14.62,-15.54,;14.61,-17.08,;12.07,-17.77,;13.44,-18.51,;14.75,-17.69,;15.84,-14.61,;15.64,-13.08,;14.21,-12.48,;16.87,-12.14,;2.92,-23.48,;1.55,-22.75,;2.96,-25.02,)| Show InChI InChI=1S/C50H72N16O9/c1-3-4-16-35(59-28(2)67)43(70)65-39-25-41(68)56-20-11-10-18-34(42(51)69)61-46(73)38(23-30-26-58-33-17-9-8-15-32(30)33)63-44(71)36(19-12-21-57-49(52)53)62-45(72)37(22-29-13-6-5-7-14-29)64-47(74)40-24-31(60-50(54)55)27-66(40)48(39)75/h5-9,13-15,17,26,31,34-40,58H,3-4,10-12,16,18-25,27H2,1-2H3,(H2,51,69)(H,56,68)(H,59,67)(H,61,73)(H,62,72)(H,63,71)(H,64,74)(H,65,70)(H4,52,53,57)(H4,54,55,60)/t31-,34-,35-,36-,37+,38-,39-,40-/m0/s1 | PDB
KEGG
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antibodypedia
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 5.70 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC4R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268799
(Ac-Nle-c[Asp-His-DNal(2')-trans-4-guanidinyl-Pro-T...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.81,12.11,4.4,41.77,39.45,wD:61.66,25.25,(17.63,-10.54,;16.26,-9.83,;16.2,-8.29,;14.83,-7.58,;14.77,-6.04,;16.07,-5.21,;16,-3.68,;17.31,-2.85,;14.64,-2.96,;13.4,-5.33,;13.34,-3.79,;12.11,-6.15,;10.74,-5.44,;9.44,-6.27,;9.5,-7.81,;10.87,-8.52,;8.21,-8.64,;6.84,-7.92,;5.54,-8.75,;4.17,-8.03,;2.88,-8.86,;1.51,-8.15,;1.44,-6.61,;.08,-5.89,;-1.22,-6.72,;.01,-4.36,;-1.35,-3.64,;-1.42,-2.1,;-.2,-1.15,;-.74,.29,;-2.29,.23,;-3.36,1.32,;-4.84,.92,;-5.24,-.57,;-4.16,-1.64,;-2.69,-1.26,;1.32,-3.53,;1.98,-4.61,;2.31,-6.15,;2.67,-4.24,;3.31,-5.82,;4.85,-5.75,;5.26,-4.27,;3.98,-3.42,;3.91,-1.88,;2.55,-1.17,;5.21,-1.05,;5.15,.48,;3.78,1.2,;2.49,.37,;1.12,1.07,;1.05,2.62,;-.31,3.33,;-.37,4.87,;.93,5.7,;2.3,4.98,;2.36,3.44,;3.72,2.73,;6.58,-1.77,;7.88,-.94,;7.81,.6,;9.24,-1.65,;10.54,-.82,;10.49,.72,;11.7,1.66,;11.17,3.11,;9.64,3.06,;9.21,1.58,;9.31,-3.19,;10.67,-3.9,;11.98,-3.07,;5.79,-6.95,;7.3,-6.73,;8.06,-7.33,;7.86,-5.31,;.21,-8.97,;-1.16,-8.26,;.27,-10.51,)| Show InChI InChI=1S/C54H69N15O9/c1-3-4-14-40(62-30(2)70)48(73)66-43-25-46(71)59-19-10-9-16-39(47(55)72)64-49(74)41(22-34-26-60-38-15-8-7-13-37(34)38)67-52(77)45-24-36(63-54(56)57)28-69(45)53(78)44(21-31-17-18-32-11-5-6-12-33(32)20-31)68-50(75)42(65-51(43)76)23-35-27-58-29-61-35/h5-8,11-13,15,17-18,20,26-27,29,36,39-45,60H,3-4,9-10,14,16,19,21-25,28H2,1-2H3,(H2,55,72)(H,58,61)(H,59,71)(H,62,70)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,75)(H4,56,57,63)/t36-,39-,40-,41-,42-,43-,44+,45-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
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| CHEMBL
PC cid
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UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.20 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC4R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50184359
((3S,6S,9R,12S,15S,23S)-15-((S)-2-acetylamino-hexan...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r,wU:21.75,50.52,12.11,4.4,39.41,wD:25.25,61.64,(19.68,-11.7,;18.32,-10.97,;18.27,-9.43,;16.91,-8.71,;16.86,-7.17,;18.17,-6.36,;18.11,-4.82,;19.42,-4,;16.76,-4.09,;15.5,-6.44,;15.45,-4.9,;14.19,-7.26,;12.83,-6.53,;11.53,-7.35,;11.58,-8.88,;12.94,-9.61,;10.27,-9.7,;8.91,-8.97,;7.6,-9.79,;6.25,-9.06,;4.94,-9.87,;3.58,-9.15,;3.53,-7.61,;2.17,-6.88,;.86,-7.7,;2.12,-5.35,;.76,-4.62,;.71,-3.08,;1.93,-2.14,;1.41,-.69,;-.14,-.74,;-1.21,.35,;-2.69,-.02,;-3.1,-1.51,;-2.03,-2.6,;-.56,-2.22,;3.43,-4.53,;4.79,-5.26,;4.84,-6.8,;6.98,-5.22,;8.76,-4.36,;10.12,-5.08,;10.17,-6.62,;8.86,-7.43,;7.5,-6.71,;6.19,-7.52,;8.83,-5.93,;6.09,-4.44,;6.04,-2.9,;4.68,-2.18,;7.35,-2.09,;7.3,-.55,;5.94,.17,;5.89,1.71,;4.53,2.44,;3.23,1.62,;3.28,.07,;4.64,-.64,;8.71,-2.82,;10.02,-2,;9.96,-.46,;11.37,-2.73,;12.68,-1.91,;12.64,-.37,;13.86,.56,;13.35,2.01,;11.81,1.97,;11.37,.5,;11.42,-4.27,;12.78,-4.99,;14.09,-4.18,;2.27,-9.96,;.91,-9.24,;2.32,-11.5,)| Show InChI InChI=1S/C50H69N15O9/c1-3-4-16-36(59-29(2)66)44(69)65-41-25-42(67)55-20-11-10-18-35(43(51)68)60-47(72)39(23-31-26-57-34-17-9-8-15-33(31)34)63-45(70)37(19-12-21-56-50(52)53)61-46(71)38(22-30-13-6-5-7-14-30)62-48(73)40(64-49(41)74)24-32-27-54-28-58-32/h5-9,13-15,17,26-28,35-41,57H,3-4,10-12,16,18-25H2,1-2H3,(H2,51,68)(H,54,58)(H,55,67)(H,59,66)(H,60,72)(H,61,71)(H,62,73)(H,63,70)(H,64,74)(H,65,69)(H4,52,53,56)/t35-,36-,37-,38+,39-,40-,41-/m0/s1 | PDB
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| Purchase
CHEMBL
PC cid
PC sid
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Similars
| Article
PubMed
| n/a | n/a | 7.5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC5R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268792
(AC-Nle-c[Asp-His-DPhe-Pro-Trp-Lys]-NH2 | CHEMBL501...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r| Show InChI InChI=1S/C49H64N12O9/c1-3-4-16-36(55-29(2)62)44(65)58-39-25-42(63)52-20-11-10-18-35(43(50)64)56-45(66)37(23-31-26-53-34-17-9-8-15-33(31)34)59-48(69)41-19-12-21-61(41)49(70)40(22-30-13-6-5-7-14-30)60-46(67)38(57-47(39)68)24-32-27-51-28-54-32/h5-9,13-15,17,26-28,35-41,53H,3-4,10-12,16,18-25H2,1-2H3,(H2,50,64)(H,51,54)(H,52,63)(H,55,62)(H,56,66)(H,57,68)(H,58,65)(H,59,69)(H,60,67)/t35-,36-,37-,38-,39-,40+,41-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC4R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268799
(Ac-Nle-c[Asp-His-DNal(2')-trans-4-guanidinyl-Pro-T...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.81,12.11,4.4,41.77,39.45,wD:61.66,25.25,(17.63,-10.54,;16.26,-9.83,;16.2,-8.29,;14.83,-7.58,;14.77,-6.04,;16.07,-5.21,;16,-3.68,;17.31,-2.85,;14.64,-2.96,;13.4,-5.33,;13.34,-3.79,;12.11,-6.15,;10.74,-5.44,;9.44,-6.27,;9.5,-7.81,;10.87,-8.52,;8.21,-8.64,;6.84,-7.92,;5.54,-8.75,;4.17,-8.03,;2.88,-8.86,;1.51,-8.15,;1.44,-6.61,;.08,-5.89,;-1.22,-6.72,;.01,-4.36,;-1.35,-3.64,;-1.42,-2.1,;-.2,-1.15,;-.74,.29,;-2.29,.23,;-3.36,1.32,;-4.84,.92,;-5.24,-.57,;-4.16,-1.64,;-2.69,-1.26,;1.32,-3.53,;1.98,-4.61,;2.31,-6.15,;2.67,-4.24,;3.31,-5.82,;4.85,-5.75,;5.26,-4.27,;3.98,-3.42,;3.91,-1.88,;2.55,-1.17,;5.21,-1.05,;5.15,.48,;3.78,1.2,;2.49,.37,;1.12,1.07,;1.05,2.62,;-.31,3.33,;-.37,4.87,;.93,5.7,;2.3,4.98,;2.36,3.44,;3.72,2.73,;6.58,-1.77,;7.88,-.94,;7.81,.6,;9.24,-1.65,;10.54,-.82,;10.49,.72,;11.7,1.66,;11.17,3.11,;9.64,3.06,;9.21,1.58,;9.31,-3.19,;10.67,-3.9,;11.98,-3.07,;5.79,-6.95,;7.3,-6.73,;8.06,-7.33,;7.86,-5.31,;.21,-8.97,;-1.16,-8.26,;.27,-10.51,)| Show InChI InChI=1S/C54H69N15O9/c1-3-4-14-40(62-30(2)70)48(73)66-43-25-46(71)59-19-10-9-16-39(47(55)72)64-49(74)41(22-34-26-60-38-15-8-7-13-37(34)38)67-52(77)45-24-36(63-54(56)57)28-69(45)53(78)44(21-31-17-18-32-11-5-6-12-33(32)20-31)68-50(75)42(65-51(43)76)23-35-27-58-29-61-35/h5-8,11-13,15,17-18,20,26-27,29,36,39-45,60H,3-4,9-10,14,16,19,21-25,28H2,1-2H3,(H2,55,72)(H,58,61)(H,59,71)(H,62,70)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,75)(H4,56,57,63)/t36-,39-,40-,41-,42-,43-,44+,45-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC5R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268800
(Ac-Nle-c[Asp-His-DNal(2')-cis-4-guanidinyl-Pro-Trp...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.81,12.11,4.4,39.45,wD:61.66,25.25,41.77,(17.08,-28.2,;15.72,-27.49,;15.65,-25.95,;14.29,-25.23,;14.22,-23.7,;15.52,-22.87,;15.46,-21.33,;16.76,-20.51,;14.09,-20.62,;12.85,-22.98,;12.79,-21.44,;11.56,-23.81,;10.19,-23.09,;8.89,-23.93,;8.95,-25.47,;10.32,-26.17,;7.66,-26.29,;6.29,-25.58,;4.99,-26.4,;3.62,-25.69,;2.33,-26.52,;.96,-25.8,;.9,-24.26,;-.47,-23.55,;-1.77,-24.38,;-.53,-22.01,;-1.9,-21.3,;-1.97,-19.76,;-.75,-18.81,;-1.29,-17.36,;-2.83,-17.43,;-3.91,-16.34,;-5.39,-16.73,;-5.79,-18.22,;-4.71,-19.3,;-3.24,-18.91,;.77,-21.19,;1.43,-22.26,;1.77,-23.81,;2.13,-21.9,;2.76,-23.47,;4.3,-23.41,;4.72,-21.93,;3.43,-21.07,;3.37,-19.54,;2,-18.82,;4.67,-18.71,;4.6,-17.17,;3.24,-16.46,;1.94,-17.29,;.57,-16.58,;.5,-15.04,;-.85,-14.32,;-.92,-12.79,;.39,-11.96,;1.75,-12.68,;1.81,-14.22,;3.17,-14.92,;6.03,-19.42,;7.33,-18.6,;7.26,-17.05,;8.7,-19.3,;10,-18.48,;9.94,-16.94,;11.15,-15.99,;10.63,-14.55,;9.09,-14.6,;8.66,-16.08,;8.76,-20.84,;10.13,-21.56,;11.43,-20.73,;5.25,-24.61,;6.76,-24.38,;7.52,-24.99,;7.32,-22.97,;-.34,-26.63,;-1.71,-25.91,;-.27,-28.17,)| Show InChI InChI=1S/C54H69N15O9/c1-3-4-14-40(62-30(2)70)48(73)66-43-25-46(71)59-19-10-9-16-39(47(55)72)64-49(74)41(22-34-26-60-38-15-8-7-13-37(34)38)67-52(77)45-24-36(63-54(56)57)28-69(45)53(78)44(21-31-17-18-32-11-5-6-12-33(32)20-31)68-50(75)42(65-51(43)76)23-35-27-58-29-61-35/h5-8,11-13,15,17-18,20,26-27,29,36,39-45,60H,3-4,9-10,14,16,19,21-25,28H2,1-2H3,(H2,55,72)(H,58,61)(H,59,71)(H,62,70)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,75)(H4,56,57,63)/t36-,39+,40+,41+,42+,43+,44-,45+/m1/s1 | PDB
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| n/a | n/a | 23 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC4R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268798
(Ac-Nle-c[Asp-His-DNaI(2')-Pro-Trp-Lys]-NH2 | CHEMB...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r| Show InChI InChI=1S/C53H66N12O9/c1-3-4-15-40(59-31(2)66)48(69)62-43-27-46(67)56-21-10-9-17-39(47(54)68)60-49(70)41(25-35-28-57-38-16-8-7-14-37(35)38)63-52(73)45-18-11-22-65(45)53(74)44(24-32-19-20-33-12-5-6-13-34(33)23-32)64-50(71)42(61-51(43)72)26-36-29-55-30-58-36/h5-8,12-14,16,19-20,23,28-30,39-45,57H,3-4,9-11,15,17-18,21-22,24-27H2,1-2H3,(H2,54,68)(H,55,58)(H,56,67)(H,59,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)/t39-,40-,41-,42-,43-,44+,45-/m0/s1 | PDB
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PubMed
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC4R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268794
(Ac-Nle-c[Asp-His-DPhe-cis-4-guanidinyl-Pro-Trp-Lys...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.76,12.11,41.72,4.4,wD:57.61,25.25,39.45,(20.33,-40.8,;18.97,-40.08,;18.92,-38.54,;17.56,-37.81,;17.51,-36.27,;18.82,-35.46,;18.77,-33.92,;20.08,-33.11,;17.41,-33.19,;16.15,-35.55,;16.1,-34.01,;14.85,-36.36,;13.49,-35.64,;12.18,-36.45,;12.23,-37.99,;13.59,-38.71,;10.92,-38.8,;9.56,-38.08,;8.26,-38.89,;6.9,-38.17,;5.59,-38.98,;4.23,-38.25,;4.18,-36.71,;2.82,-35.99,;1.52,-36.8,;2.77,-34.45,;1.41,-33.72,;1.36,-32.19,;2.59,-31.24,;2.06,-29.79,;.52,-29.85,;-.55,-28.75,;-2.04,-29.13,;-2.45,-30.61,;-1.37,-31.7,;.1,-31.32,;4.08,-33.64,;4.74,-34.72,;5.06,-36.27,;5.44,-34.36,;6.06,-35.94,;7.6,-35.89,;8.02,-34.41,;6.75,-33.55,;6.7,-32.01,;5.34,-31.28,;8,-31.2,;7.95,-29.66,;6.59,-28.93,;6.55,-27.39,;5.19,-26.67,;3.88,-27.48,;3.94,-29.03,;5.29,-29.75,;9.36,-31.92,;10.67,-31.11,;10.62,-29.57,;12.03,-31.83,;13.33,-31.02,;13.29,-29.48,;14.51,-28.54,;14,-27.09,;12.46,-27.13,;12.02,-28.61,;12.08,-33.37,;13.44,-34.1,;14.74,-33.28,;8.54,-37.11,;10.04,-36.73,;10.8,-37.54,;10.65,-35.47,;2.93,-39.07,;1.57,-38.34,;2.98,-40.61,)| Show InChI InChI=1S/C50H67N15O9/c1-3-4-15-36(58-28(2)66)44(69)62-39-23-42(67)55-18-11-10-17-35(43(51)68)60-45(70)37(20-30-24-56-34-16-9-8-14-33(30)34)63-48(73)41-22-32(59-50(52)53)26-65(41)49(74)40(19-29-12-6-5-7-13-29)64-46(71)38(61-47(39)72)21-31-25-54-27-57-31/h5-9,12-14,16,24-25,27,32,35-41,56H,3-4,10-11,15,17-23,26H2,1-2H3,(H2,51,68)(H,54,57)(H,55,67)(H,58,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)(H4,52,53,59)/t32-,35-,36-,37-,38-,39-,40+,41+/m0/s1 | PDB
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PubMed
| n/a | n/a | 39 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC4R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268793
(Ac-Nle-c[Asp-His-DPhe-trans-4-guanidinyl-Pro-Trp-L...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.76,12.11,41.72,4.4,39.45,wD:57.61,25.25,(17.82,-24,;16.46,-23.28,;16.41,-21.74,;15.05,-21.01,;15,-19.47,;16.31,-18.66,;16.26,-17.12,;17.56,-16.31,;14.9,-16.39,;13.64,-18.75,;13.59,-17.21,;12.33,-19.56,;10.98,-18.84,;9.67,-19.65,;9.72,-21.19,;11.08,-21.91,;8.41,-22,;7.05,-21.28,;5.75,-22.09,;4.39,-21.37,;3.08,-22.18,;1.72,-21.45,;1.67,-19.91,;.31,-19.19,;-1,-20,;.26,-17.65,;-1.1,-16.92,;-1.15,-15.39,;.08,-14.44,;-.45,-12.99,;-2,-13.05,;-3.06,-11.95,;-4.55,-12.33,;-4.96,-13.81,;-3.88,-14.9,;-2.41,-14.52,;1.57,-16.84,;2.22,-17.92,;2.54,-19.47,;2.93,-17.56,;3.55,-19.14,;5.08,-19.09,;5.51,-17.61,;4.23,-16.75,;4.18,-15.21,;2.82,-14.48,;5.49,-14.4,;5.44,-12.86,;4.08,-12.13,;4.03,-10.59,;2.68,-9.87,;1.37,-10.68,;1.42,-12.23,;2.78,-12.95,;6.85,-15.12,;8.16,-14.31,;8.11,-12.77,;9.51,-15.03,;10.82,-14.22,;10.78,-12.68,;12,-11.74,;11.49,-10.29,;9.95,-10.33,;9.51,-11.81,;9.57,-16.57,;10.92,-17.3,;12.23,-16.48,;6.03,-20.31,;7.52,-19.93,;8.28,-20.74,;8.13,-18.67,;.41,-22.27,;-.95,-21.54,;.46,-23.81,)| Show InChI InChI=1S/C50H67N15O9/c1-3-4-15-36(58-28(2)66)44(69)62-39-23-42(67)55-18-11-10-17-35(43(51)68)60-45(70)37(20-30-24-56-34-16-9-8-14-33(30)34)63-48(73)41-22-32(59-50(52)53)26-65(41)49(74)40(19-29-12-6-5-7-13-29)64-46(71)38(61-47(39)72)21-31-25-54-27-57-31/h5-9,12-14,16,24-25,27,32,35-41,56H,3-4,10-11,15,17-23,26H2,1-2H3,(H2,51,68)(H,54,57)(H,55,67)(H,58,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)(H4,52,53,59)/t32-,35-,36-,37-,38-,39-,40+,41-/m0/s1 | PDB
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PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC4R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268804
(Ac-Tyr-Val-Nle-Gly-His-DPhe-Pro-Trp-Asp-Arg-Phe-Gl...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r,wU:8.8,45.46,59.63,96.101,35.35,77.82,wD:4.4,12.21,63.66,85.90,(2.68,-6.73,;1.36,-7.52,;.01,-6.75,;-1.31,-7.53,;-2.65,-6.78,;-3.99,-7.57,;-3.97,-9.11,;-2.62,-9.86,;-5.3,-9.89,;-5.28,-11.43,;-6.61,-12.22,;-7.94,-11.46,;-6.59,-13.75,;-5.25,-14.51,;-3.92,-13.72,;-3.94,-12.19,;-2.61,-11.4,;-1.26,-12.16,;.06,-11.37,;-1.25,-13.71,;-2.58,-14.49,;-7.92,-14.54,;-7.92,-16.08,;-9.23,-16.86,;-6.56,-16.83,;-6.64,-9.14,;-6.65,-7.59,;-7.95,-9.92,;-2.67,-5.24,;-4.01,-4.49,;-1.35,-4.46,;-1.37,-2.92,;-.03,-2.13,;1.32,-2.89,;-.05,-.59,;1.27,.2,;1.26,1.73,;-.08,2.49,;-.25,4.02,;-1.77,4.33,;-2.52,2.99,;-1.48,1.85,;2.62,-.57,;2.64,-2.11,;3.94,.22,;5.29,-.54,;5.31,-2.09,;6.64,-2.84,;6.66,-4.39,;8,-5.15,;9.32,-4.36,;9.3,-2.82,;7.96,-2.06,;6.65,.17,;7.9,-.73,;6.72,1.71,;5.7,2.87,;6.48,4.19,;7.98,3.86,;8.13,2.32,;9.45,1.54,;9.44,-0,;10.8,2.29,;12.11,1.49,;12.1,-.05,;13.38,-.9,;14.82,-.37,;15.78,-1.58,;14.93,-2.86,;15.31,-4.35,;14.21,-5.43,;12.73,-5.02,;12.34,-3.52,;13.44,-2.45,;13.46,2.25,;13.47,3.79,;14.78,1.46,;16.13,2.22,;16.14,3.76,;17.48,4.52,;18.82,3.75,;17.5,6.06,;17.45,1.44,;17.43,-.1,;18.79,2.2,;20.11,1.4,;20.09,-.14,;21.42,-.92,;21.41,-2.46,;22.74,-3.24,;22.71,-4.78,;21.38,-5.53,;24.05,-5.55,;21.45,2.16,;21.46,3.7,;22.79,1.39,;24.13,2.15,;24.14,3.68,;25.48,4.44,;26.81,3.66,;28.16,4.41,;28.17,5.95,;26.84,6.74,;25.51,5.98,;25.46,1.36,;25.44,-.18,;26.8,2.12,;28.12,1.33,;29.46,2.09,;30.79,1.3,;29.47,3.63,)| Show InChI InChI=1S/C76H99N19O16/c1-5-6-22-53(89-74(110)65(43(2)3)94-72(108)56(86-44(4)96)33-47-26-28-50(97)29-27-47)66(102)84-41-63(99)87-58(36-49-39-80-42-85-49)70(106)93-60(34-46-19-11-8-12-20-46)75(111)95-31-16-25-61(95)73(109)92-57(35-48-38-82-52-23-14-13-21-51(48)52)69(105)91-59(37-64(100)101)71(107)88-54(24-15-30-81-76(78)79)68(104)90-55(67(103)83-40-62(77)98)32-45-17-9-7-10-18-45/h7-14,17-21,23,26-29,38-39,42-43,53-61,65,82,97H,5-6,15-16,22,24-25,30-37,40-41H2,1-4H3,(H2,77,98)(H,80,85)(H,83,103)(H,84,102)(H,86,96)(H,87,99)(H,88,107)(H,89,110)(H,90,104)(H,91,105)(H,92,109)(H,93,106)(H,94,108)(H,100,101)(H4,78,79,81)/t53-,54-,55-,56-,57-,58-,59-,60+,61-,65-/m0/s1 | PDB
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PubMed
| n/a | n/a | 190 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC1R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268804
(Ac-Tyr-Val-Nle-Gly-His-DPhe-Pro-Trp-Asp-Arg-Phe-Gl...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r,wU:8.8,45.46,59.63,96.101,35.35,77.82,wD:4.4,12.21,63.66,85.90,(2.68,-6.73,;1.36,-7.52,;.01,-6.75,;-1.31,-7.53,;-2.65,-6.78,;-3.99,-7.57,;-3.97,-9.11,;-2.62,-9.86,;-5.3,-9.89,;-5.28,-11.43,;-6.61,-12.22,;-7.94,-11.46,;-6.59,-13.75,;-5.25,-14.51,;-3.92,-13.72,;-3.94,-12.19,;-2.61,-11.4,;-1.26,-12.16,;.06,-11.37,;-1.25,-13.71,;-2.58,-14.49,;-7.92,-14.54,;-7.92,-16.08,;-9.23,-16.86,;-6.56,-16.83,;-6.64,-9.14,;-6.65,-7.59,;-7.95,-9.92,;-2.67,-5.24,;-4.01,-4.49,;-1.35,-4.46,;-1.37,-2.92,;-.03,-2.13,;1.32,-2.89,;-.05,-.59,;1.27,.2,;1.26,1.73,;-.08,2.49,;-.25,4.02,;-1.77,4.33,;-2.52,2.99,;-1.48,1.85,;2.62,-.57,;2.64,-2.11,;3.94,.22,;5.29,-.54,;5.31,-2.09,;6.64,-2.84,;6.66,-4.39,;8,-5.15,;9.32,-4.36,;9.3,-2.82,;7.96,-2.06,;6.65,.17,;7.9,-.73,;6.72,1.71,;5.7,2.87,;6.48,4.19,;7.98,3.86,;8.13,2.32,;9.45,1.54,;9.44,-0,;10.8,2.29,;12.11,1.49,;12.1,-.05,;13.38,-.9,;14.82,-.37,;15.78,-1.58,;14.93,-2.86,;15.31,-4.35,;14.21,-5.43,;12.73,-5.02,;12.34,-3.52,;13.44,-2.45,;13.46,2.25,;13.47,3.79,;14.78,1.46,;16.13,2.22,;16.14,3.76,;17.48,4.52,;18.82,3.75,;17.5,6.06,;17.45,1.44,;17.43,-.1,;18.79,2.2,;20.11,1.4,;20.09,-.14,;21.42,-.92,;21.41,-2.46,;22.74,-3.24,;22.71,-4.78,;21.38,-5.53,;24.05,-5.55,;21.45,2.16,;21.46,3.7,;22.79,1.39,;24.13,2.15,;24.14,3.68,;25.48,4.44,;26.81,3.66,;28.16,4.41,;28.17,5.95,;26.84,6.74,;25.51,5.98,;25.46,1.36,;25.44,-.18,;26.8,2.12,;28.12,1.33,;29.46,2.09,;30.79,1.3,;29.47,3.63,)| Show InChI InChI=1S/C76H99N19O16/c1-5-6-22-53(89-74(110)65(43(2)3)94-72(108)56(86-44(4)96)33-47-26-28-50(97)29-27-47)66(102)84-41-63(99)87-58(36-49-39-80-42-85-49)70(106)93-60(34-46-19-11-8-12-20-46)75(111)95-31-16-25-61(95)73(109)92-57(35-48-38-82-52-23-14-13-21-51(48)52)69(105)91-59(37-64(100)101)71(107)88-54(24-15-30-81-76(78)79)68(104)90-55(67(103)83-40-62(77)98)32-45-17-9-7-10-18-45/h7-14,17-21,23,26-29,38-39,42-43,53-61,65,82,97H,5-6,15-16,22,24-25,30-37,40-41H2,1-4H3,(H2,77,98)(H,80,85)(H,83,103)(H,84,102)(H,86,96)(H,87,99)(H,88,107)(H,89,110)(H,90,104)(H,91,105)(H,92,109)(H,93,106)(H,94,108)(H,100,101)(H4,78,79,81)/t53-,54-,55-,56-,57-,58-,59-,60+,61-,65-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
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| CHEMBL
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UniChem
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| Article
PubMed
| n/a | n/a | 270 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC4R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268800
(Ac-Nle-c[Asp-His-DNal(2')-cis-4-guanidinyl-Pro-Trp...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.81,12.11,4.4,39.45,wD:61.66,25.25,41.77,(17.08,-28.2,;15.72,-27.49,;15.65,-25.95,;14.29,-25.23,;14.22,-23.7,;15.52,-22.87,;15.46,-21.33,;16.76,-20.51,;14.09,-20.62,;12.85,-22.98,;12.79,-21.44,;11.56,-23.81,;10.19,-23.09,;8.89,-23.93,;8.95,-25.47,;10.32,-26.17,;7.66,-26.29,;6.29,-25.58,;4.99,-26.4,;3.62,-25.69,;2.33,-26.52,;.96,-25.8,;.9,-24.26,;-.47,-23.55,;-1.77,-24.38,;-.53,-22.01,;-1.9,-21.3,;-1.97,-19.76,;-.75,-18.81,;-1.29,-17.36,;-2.83,-17.43,;-3.91,-16.34,;-5.39,-16.73,;-5.79,-18.22,;-4.71,-19.3,;-3.24,-18.91,;.77,-21.19,;1.43,-22.26,;1.77,-23.81,;2.13,-21.9,;2.76,-23.47,;4.3,-23.41,;4.72,-21.93,;3.43,-21.07,;3.37,-19.54,;2,-18.82,;4.67,-18.71,;4.6,-17.17,;3.24,-16.46,;1.94,-17.29,;.57,-16.58,;.5,-15.04,;-.85,-14.32,;-.92,-12.79,;.39,-11.96,;1.75,-12.68,;1.81,-14.22,;3.17,-14.92,;6.03,-19.42,;7.33,-18.6,;7.26,-17.05,;8.7,-19.3,;10,-18.48,;9.94,-16.94,;11.15,-15.99,;10.63,-14.55,;9.09,-14.6,;8.66,-16.08,;8.76,-20.84,;10.13,-21.56,;11.43,-20.73,;5.25,-24.61,;6.76,-24.38,;7.52,-24.99,;7.32,-22.97,;-.34,-26.63,;-1.71,-25.91,;-.27,-28.17,)| Show InChI InChI=1S/C54H69N15O9/c1-3-4-14-40(62-30(2)70)48(73)66-43-25-46(71)59-19-10-9-16-39(47(55)72)64-49(74)41(22-34-26-60-38-15-8-7-13-37(34)38)67-52(77)45-24-36(63-54(56)57)28-69(45)53(78)44(21-31-17-18-32-11-5-6-12-33(32)20-31)68-50(75)42(65-51(43)76)23-35-27-58-29-61-35/h5-8,11-13,15,17-18,20,26-27,29,36,39-45,60H,3-4,9-10,14,16,19,21-25,28H2,1-2H3,(H2,55,72)(H,58,61)(H,59,71)(H,62,70)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,75)(H4,56,57,63)/t36-,39+,40+,41+,42+,43+,44-,45+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 400 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268793
(Ac-Nle-c[Asp-His-DPhe-trans-4-guanidinyl-Pro-Trp-L...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.76,12.11,41.72,4.4,39.45,wD:57.61,25.25,(17.82,-24,;16.46,-23.28,;16.41,-21.74,;15.05,-21.01,;15,-19.47,;16.31,-18.66,;16.26,-17.12,;17.56,-16.31,;14.9,-16.39,;13.64,-18.75,;13.59,-17.21,;12.33,-19.56,;10.98,-18.84,;9.67,-19.65,;9.72,-21.19,;11.08,-21.91,;8.41,-22,;7.05,-21.28,;5.75,-22.09,;4.39,-21.37,;3.08,-22.18,;1.72,-21.45,;1.67,-19.91,;.31,-19.19,;-1,-20,;.26,-17.65,;-1.1,-16.92,;-1.15,-15.39,;.08,-14.44,;-.45,-12.99,;-2,-13.05,;-3.06,-11.95,;-4.55,-12.33,;-4.96,-13.81,;-3.88,-14.9,;-2.41,-14.52,;1.57,-16.84,;2.22,-17.92,;2.54,-19.47,;2.93,-17.56,;3.55,-19.14,;5.08,-19.09,;5.51,-17.61,;4.23,-16.75,;4.18,-15.21,;2.82,-14.48,;5.49,-14.4,;5.44,-12.86,;4.08,-12.13,;4.03,-10.59,;2.68,-9.87,;1.37,-10.68,;1.42,-12.23,;2.78,-12.95,;6.85,-15.12,;8.16,-14.31,;8.11,-12.77,;9.51,-15.03,;10.82,-14.22,;10.78,-12.68,;12,-11.74,;11.49,-10.29,;9.95,-10.33,;9.51,-11.81,;9.57,-16.57,;10.92,-17.3,;12.23,-16.48,;6.03,-20.31,;7.52,-19.93,;8.28,-20.74,;8.13,-18.67,;.41,-22.27,;-.95,-21.54,;.46,-23.81,)| Show InChI InChI=1S/C50H67N15O9/c1-3-4-15-36(58-28(2)66)44(69)62-39-23-42(67)55-18-11-10-17-35(43(51)68)60-45(70)37(20-30-24-56-34-16-9-8-14-33(30)34)63-48(73)41-22-32(59-50(52)53)26-65(41)49(74)40(19-29-12-6-5-7-13-29)64-46(71)38(61-47(39)72)21-31-25-54-27-57-31/h5-9,12-14,16,24-25,27,32,35-41,56H,3-4,10-11,15,17-23,26H2,1-2H3,(H2,51,68)(H,54,57)(H,55,67)(H,58,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)(H4,52,53,59)/t32-,35-,36-,37-,38-,39-,40+,41-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 590 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC5R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268798
(Ac-Nle-c[Asp-His-DNaI(2')-Pro-Trp-Lys]-NH2 | CHEMB...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r| Show InChI InChI=1S/C53H66N12O9/c1-3-4-15-40(59-31(2)66)48(69)62-43-27-46(67)56-21-10-9-17-39(47(54)68)60-49(70)41(25-35-28-57-38-16-8-7-14-37(35)38)63-52(73)45-18-11-22-65(45)53(74)44(24-32-19-20-33-12-5-6-13-34(33)23-32)64-50(71)42(61-51(43)72)26-36-29-55-30-58-36/h5-8,12-14,16,19-20,23,28-30,39-45,57H,3-4,9-11,15,17-18,21-22,24-27H2,1-2H3,(H2,54,68)(H,55,58)(H,56,67)(H,59,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)/t39-,40-,41-,42-,43-,44+,45-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 600 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268805
(Ac-Tyr-Val-Nle-Gly-His-DPhe-trans-Xaa-Trp-Asp-Arg-...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O)N=C(N)N |r,wU:8.8,45.46,59.63,96.101,35.35,77.82,wD:4.4,57.117,12.21,63.66,85.90,(3.89,-26.77,;2.57,-27.55,;1.22,-26.79,;-.1,-27.57,;-1.45,-26.81,;-2.78,-27.6,;-2.76,-29.14,;-1.41,-29.89,;-4.09,-29.92,;-4.07,-31.46,;-5.4,-32.25,;-6.73,-31.49,;-5.38,-33.78,;-4.04,-34.54,;-2.72,-33.75,;-2.73,-32.22,;-1.4,-31.43,;-.06,-32.19,;1.27,-31.4,;-.04,-33.74,;-1.37,-34.52,;-6.71,-34.57,;-6.71,-36.11,;-8.02,-36.89,;-5.35,-36.86,;-5.43,-29.17,;-5.44,-27.63,;-6.74,-29.95,;-1.46,-25.28,;-2.8,-24.52,;-.14,-24.49,;-.16,-22.95,;1.17,-22.16,;2.52,-22.92,;1.16,-20.62,;2.48,-19.84,;2.46,-18.3,;1.13,-17.55,;.96,-16.02,;-.56,-15.71,;-1.31,-17.05,;-.27,-18.18,;3.82,-20.6,;3.85,-22.14,;5.15,-19.82,;6.5,-20.57,;6.51,-22.12,;7.85,-22.87,;7.87,-24.42,;9.21,-25.18,;10.53,-24.39,;10.51,-22.85,;9.17,-22.09,;7.86,-19.86,;9.11,-20.76,;7.93,-18.32,;6.9,-17.17,;7.69,-15.84,;9.19,-16.18,;9.34,-17.71,;10.66,-18.5,;10.65,-20.04,;12,-17.74,;13.32,-18.54,;13.31,-20.08,;14.59,-20.94,;16.03,-20.4,;16.98,-21.61,;16.14,-22.89,;16.51,-24.38,;15.41,-25.47,;13.93,-25.05,;13.55,-23.56,;14.65,-22.48,;14.67,-17.78,;14.68,-16.24,;15.99,-18.57,;17.33,-17.82,;17.34,-16.27,;18.68,-15.52,;20.02,-16.29,;18.7,-13.97,;18.66,-18.59,;18.64,-20.14,;20,-17.84,;21.32,-18.63,;21.3,-20.18,;22.62,-20.95,;22.61,-22.5,;23.94,-23.27,;23.91,-24.81,;22.59,-25.56,;25.26,-25.58,;22.66,-17.88,;22.67,-16.34,;23.99,-18.65,;25.33,-17.89,;25.35,-16.35,;26.69,-15.6,;28.02,-16.38,;29.36,-15.63,;29.38,-14.09,;28.05,-13.3,;26.71,-14.06,;26.66,-18.67,;26.64,-20.22,;28,-17.92,;29.32,-18.7,;30.66,-17.95,;31.99,-18.73,;30.68,-16.41,;7.08,-14.43,;7.99,-13.19,;7.38,-11.78,;9.52,-13.37,)| Show InChI InChI=1S/C77H102N22O16/c1-5-6-21-53(93-74(114)65(42(2)3)98-72(112)56(89-43(4)100)30-46-24-26-50(101)27-25-46)66(106)87-39-63(103)91-58(33-48-37-83-41-88-48)70(110)97-60(31-45-18-11-8-12-19-45)75(115)99-40-49(90-77(81)82)34-61(99)73(113)96-57(32-47-36-85-52-22-14-13-20-51(47)52)69(109)95-59(35-64(104)105)71(111)92-54(23-15-28-84-76(79)80)68(108)94-55(67(107)86-38-62(78)102)29-44-16-9-7-10-17-44/h7-14,16-20,22,24-27,36-37,41-42,49,53-61,65,85,101H,5-6,15,21,23,28-35,38-40H2,1-4H3,(H2,78,102)(H,83,88)(H,86,107)(H,87,106)(H,89,100)(H,91,103)(H,92,111)(H,93,114)(H,94,108)(H,95,109)(H,96,113)(H,97,110)(H,98,112)(H,104,105)(H4,79,80,84)(H4,81,82,90)/t49-,53+,54+,55+,56+,57+,58+,59+,60-,61+,65+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 830 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC1R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268803
(Ac-Tyr-Val-Nle-Gly-His-DPhe-cis-Xaa-Trp-Asp-Arg-Ph...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O)N=C(N)N |r,wU:8.8,45.46,59.63,57.117,96.101,35.35,77.82,wD:4.4,12.21,63.66,85.90,(2.53,-50.05,;1.21,-50.83,;-.13,-50.07,;-1.45,-50.85,;-2.8,-50.09,;-4.13,-50.88,;-4.11,-52.42,;-2.77,-53.17,;-5.44,-53.2,;-5.43,-54.75,;-6.75,-55.53,;-8.09,-54.77,;-6.74,-57.06,;-5.4,-57.82,;-4.07,-57.04,;-4.09,-55.5,;-2.76,-54.71,;-1.41,-55.47,;-.08,-54.68,;-1.39,-57.02,;-2.73,-57.8,;-8.07,-57.85,;-8.06,-59.39,;-9.38,-60.18,;-6.71,-60.14,;-6.78,-52.45,;-6.8,-50.91,;-8.1,-53.23,;-2.82,-48.56,;-4.16,-47.8,;-1.49,-47.77,;-1.51,-46.23,;-.18,-45.44,;1.17,-46.2,;-.2,-43.9,;1.13,-43.12,;1.11,-41.58,;-.23,-40.83,;-.4,-39.3,;-1.91,-38.99,;-2.66,-40.33,;-1.63,-41.47,;2.47,-43.88,;2.49,-45.42,;3.8,-43.1,;5.14,-43.85,;5.16,-45.4,;6.5,-46.15,;6.51,-47.7,;7.85,-48.46,;9.17,-47.68,;9.16,-46.14,;7.81,-45.37,;6.5,-43.14,;7.76,-44.04,;6.57,-41.61,;5.55,-40.45,;6.33,-39.12,;7.84,-39.46,;7.99,-40.99,;9.31,-41.78,;9.3,-43.32,;10.65,-41.02,;11.97,-41.82,;11.95,-43.36,;13.23,-44.22,;14.68,-43.68,;15.63,-44.89,;14.78,-46.18,;15.16,-47.67,;14.06,-48.75,;12.58,-48.33,;12.19,-46.84,;13.3,-45.76,;13.31,-41.06,;13.32,-39.52,;14.64,-41.85,;15.98,-41.1,;15.99,-39.56,;17.33,-38.8,;18.67,-39.57,;17.35,-37.26,;17.3,-41.87,;17.29,-43.42,;18.65,-41.12,;19.96,-41.91,;19.94,-43.46,;21.27,-44.24,;21.26,-45.78,;22.59,-46.55,;22.56,-48.09,;21.24,-48.84,;23.9,-48.86,;21.3,-41.16,;21.31,-39.62,;22.64,-41.93,;23.98,-41.17,;23.99,-39.64,;25.33,-38.88,;26.66,-39.66,;28.01,-38.91,;28.02,-37.37,;26.7,-36.58,;25.36,-37.34,;25.31,-41.95,;25.29,-43.5,;26.65,-41.2,;27.97,-41.99,;29.31,-41.23,;30.64,-42.01,;29.32,-39.69,;5.72,-37.71,;6.64,-36.47,;6.03,-35.06,;8.17,-36.65,)| Show InChI InChI=1S/C77H102N22O16/c1-5-6-21-53(93-74(114)65(42(2)3)98-72(112)56(89-43(4)100)30-46-24-26-50(101)27-25-46)66(106)87-39-63(103)91-58(33-48-37-83-41-88-48)70(110)97-60(31-45-18-11-8-12-19-45)75(115)99-40-49(90-77(81)82)34-61(99)73(113)96-57(32-47-36-85-52-22-14-13-20-51(47)52)69(109)95-59(35-64(104)105)71(111)92-54(23-15-28-84-76(79)80)68(108)94-55(67(107)86-38-62(78)102)29-44-16-9-7-10-17-44/h7-14,16-20,22,24-27,36-37,41-42,49,53-61,65,85,101H,5-6,15,21,23,28-35,38-40H2,1-4H3,(H2,78,102)(H,83,88)(H,86,107)(H,87,106)(H,89,100)(H,91,103)(H,92,111)(H,93,114)(H,94,108)(H,95,109)(H,96,113)(H,97,110)(H,98,112)(H,104,105)(H4,79,80,84)(H4,81,82,90)/t49-,53-,54-,55-,56-,57-,58-,59-,60+,61-,65-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268799
(Ac-Nle-c[Asp-His-DNal(2')-trans-4-guanidinyl-Pro-T...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.81,12.11,4.4,41.77,39.45,wD:61.66,25.25,(17.63,-10.54,;16.26,-9.83,;16.2,-8.29,;14.83,-7.58,;14.77,-6.04,;16.07,-5.21,;16,-3.68,;17.31,-2.85,;14.64,-2.96,;13.4,-5.33,;13.34,-3.79,;12.11,-6.15,;10.74,-5.44,;9.44,-6.27,;9.5,-7.81,;10.87,-8.52,;8.21,-8.64,;6.84,-7.92,;5.54,-8.75,;4.17,-8.03,;2.88,-8.86,;1.51,-8.15,;1.44,-6.61,;.08,-5.89,;-1.22,-6.72,;.01,-4.36,;-1.35,-3.64,;-1.42,-2.1,;-.2,-1.15,;-.74,.29,;-2.29,.23,;-3.36,1.32,;-4.84,.92,;-5.24,-.57,;-4.16,-1.64,;-2.69,-1.26,;1.32,-3.53,;1.98,-4.61,;2.31,-6.15,;2.67,-4.24,;3.31,-5.82,;4.85,-5.75,;5.26,-4.27,;3.98,-3.42,;3.91,-1.88,;2.55,-1.17,;5.21,-1.05,;5.15,.48,;3.78,1.2,;2.49,.37,;1.12,1.07,;1.05,2.62,;-.31,3.33,;-.37,4.87,;.93,5.7,;2.3,4.98,;2.36,3.44,;3.72,2.73,;6.58,-1.77,;7.88,-.94,;7.81,.6,;9.24,-1.65,;10.54,-.82,;10.49,.72,;11.7,1.66,;11.17,3.11,;9.64,3.06,;9.21,1.58,;9.31,-3.19,;10.67,-3.9,;11.98,-3.07,;5.79,-6.95,;7.3,-6.73,;8.06,-7.33,;7.86,-5.31,;.21,-8.97,;-1.16,-8.26,;.27,-10.51,)| Show InChI InChI=1S/C54H69N15O9/c1-3-4-14-40(62-30(2)70)48(73)66-43-25-46(71)59-19-10-9-16-39(47(55)72)64-49(74)41(22-34-26-60-38-15-8-7-13-37(34)38)67-52(77)45-24-36(63-54(56)57)28-69(45)53(78)44(21-31-17-18-32-11-5-6-12-33(32)20-31)68-50(75)42(65-51(43)76)23-35-27-58-29-61-35/h5-8,11-13,15,17-18,20,26-27,29,36,39-45,60H,3-4,9-10,14,16,19,21-25,28H2,1-2H3,(H2,55,72)(H,58,61)(H,59,71)(H,62,70)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,75)(H4,56,57,63)/t36-,39-,40-,41-,42-,43-,44+,45-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268793
(Ac-Nle-c[Asp-His-DPhe-trans-4-guanidinyl-Pro-Trp-L...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.76,12.11,41.72,4.4,39.45,wD:57.61,25.25,(17.82,-24,;16.46,-23.28,;16.41,-21.74,;15.05,-21.01,;15,-19.47,;16.31,-18.66,;16.26,-17.12,;17.56,-16.31,;14.9,-16.39,;13.64,-18.75,;13.59,-17.21,;12.33,-19.56,;10.98,-18.84,;9.67,-19.65,;9.72,-21.19,;11.08,-21.91,;8.41,-22,;7.05,-21.28,;5.75,-22.09,;4.39,-21.37,;3.08,-22.18,;1.72,-21.45,;1.67,-19.91,;.31,-19.19,;-1,-20,;.26,-17.65,;-1.1,-16.92,;-1.15,-15.39,;.08,-14.44,;-.45,-12.99,;-2,-13.05,;-3.06,-11.95,;-4.55,-12.33,;-4.96,-13.81,;-3.88,-14.9,;-2.41,-14.52,;1.57,-16.84,;2.22,-17.92,;2.54,-19.47,;2.93,-17.56,;3.55,-19.14,;5.08,-19.09,;5.51,-17.61,;4.23,-16.75,;4.18,-15.21,;2.82,-14.48,;5.49,-14.4,;5.44,-12.86,;4.08,-12.13,;4.03,-10.59,;2.68,-9.87,;1.37,-10.68,;1.42,-12.23,;2.78,-12.95,;6.85,-15.12,;8.16,-14.31,;8.11,-12.77,;9.51,-15.03,;10.82,-14.22,;10.78,-12.68,;12,-11.74,;11.49,-10.29,;9.95,-10.33,;9.51,-11.81,;9.57,-16.57,;10.92,-17.3,;12.23,-16.48,;6.03,-20.31,;7.52,-19.93,;8.28,-20.74,;8.13,-18.67,;.41,-22.27,;-.95,-21.54,;.46,-23.81,)| Show InChI InChI=1S/C50H67N15O9/c1-3-4-15-36(58-28(2)66)44(69)62-39-23-42(67)55-18-11-10-17-35(43(51)68)60-45(70)37(20-30-24-56-34-16-9-8-14-33(30)34)63-48(73)41-22-32(59-50(52)53)26-65(41)49(74)40(19-29-12-6-5-7-13-29)64-46(71)38(61-47(39)72)21-31-25-54-27-57-31/h5-9,12-14,16,24-25,27,32,35-41,56H,3-4,10-11,15,17-23,26H2,1-2H3,(H2,51,68)(H,54,57)(H,55,67)(H,58,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)(H4,52,53,59)/t32-,35-,36-,37-,38-,39-,40+,41-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268792
(AC-Nle-c[Asp-His-DPhe-Pro-Trp-Lys]-NH2 | CHEMBL501...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r| Show InChI InChI=1S/C49H64N12O9/c1-3-4-16-36(55-29(2)62)44(65)58-39-25-42(63)52-20-11-10-18-35(43(50)64)56-45(66)37(23-31-26-53-34-17-9-8-15-33(31)34)59-48(69)41-19-12-21-61(41)49(70)40(22-30-13-6-5-7-14-30)60-46(67)38(57-47(39)68)24-32-27-51-28-54-32/h5-9,13-15,17,26-28,35-41,53H,3-4,10-12,16,18-25H2,1-2H3,(H2,50,64)(H,51,54)(H,52,63)(H,55,62)(H,56,66)(H,57,68)(H,58,65)(H,59,69)(H,60,67)/t35-,36-,37-,38-,39-,40+,41-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268799
(Ac-Nle-c[Asp-His-DNal(2')-trans-4-guanidinyl-Pro-T...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.81,12.11,4.4,41.77,39.45,wD:61.66,25.25,(17.63,-10.54,;16.26,-9.83,;16.2,-8.29,;14.83,-7.58,;14.77,-6.04,;16.07,-5.21,;16,-3.68,;17.31,-2.85,;14.64,-2.96,;13.4,-5.33,;13.34,-3.79,;12.11,-6.15,;10.74,-5.44,;9.44,-6.27,;9.5,-7.81,;10.87,-8.52,;8.21,-8.64,;6.84,-7.92,;5.54,-8.75,;4.17,-8.03,;2.88,-8.86,;1.51,-8.15,;1.44,-6.61,;.08,-5.89,;-1.22,-6.72,;.01,-4.36,;-1.35,-3.64,;-1.42,-2.1,;-.2,-1.15,;-.74,.29,;-2.29,.23,;-3.36,1.32,;-4.84,.92,;-5.24,-.57,;-4.16,-1.64,;-2.69,-1.26,;1.32,-3.53,;1.98,-4.61,;2.31,-6.15,;2.67,-4.24,;3.31,-5.82,;4.85,-5.75,;5.26,-4.27,;3.98,-3.42,;3.91,-1.88,;2.55,-1.17,;5.21,-1.05,;5.15,.48,;3.78,1.2,;2.49,.37,;1.12,1.07,;1.05,2.62,;-.31,3.33,;-.37,4.87,;.93,5.7,;2.3,4.98,;2.36,3.44,;3.72,2.73,;6.58,-1.77,;7.88,-.94,;7.81,.6,;9.24,-1.65,;10.54,-.82,;10.49,.72,;11.7,1.66,;11.17,3.11,;9.64,3.06,;9.21,1.58,;9.31,-3.19,;10.67,-3.9,;11.98,-3.07,;5.79,-6.95,;7.3,-6.73,;8.06,-7.33,;7.86,-5.31,;.21,-8.97,;-1.16,-8.26,;.27,-10.51,)| Show InChI InChI=1S/C54H69N15O9/c1-3-4-14-40(62-30(2)70)48(73)66-43-25-46(71)59-19-10-9-16-39(47(55)72)64-49(74)41(22-34-26-60-38-15-8-7-13-37(34)38)67-52(77)45-24-36(63-54(56)57)28-69(45)53(78)44(21-31-17-18-32-11-5-6-12-33(32)20-31)68-50(75)42(65-51(43)76)23-35-27-58-29-61-35/h5-8,11-13,15,17-18,20,26-27,29,36,39-45,60H,3-4,9-10,14,16,19,21-25,28H2,1-2H3,(H2,55,72)(H,58,61)(H,59,71)(H,62,70)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,75)(H4,56,57,63)/t36-,39-,40-,41-,42-,43-,44+,45-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Displacement of [125I][Nle4,Dphe7]-alpha-MSH from human MC3R expressed in HEK293 cells |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268795
(Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DPhe-Arg-Trp-L...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,63.72,12.11,21.76,wD:25.25,39.41,61.68,(21.05,-10.24,;19.69,-9.52,;19.64,-7.97,;18.28,-7.25,;18.23,-5.71,;19.54,-4.89,;19.48,-3.35,;20.79,-2.54,;18.13,-2.63,;16.87,-4.98,;16.82,-3.44,;15.56,-5.8,;14.2,-5.07,;12.89,-5.89,;12.94,-7.43,;14.3,-8.15,;11.63,-8.24,;10.27,-7.52,;8.96,-8.33,;7.6,-7.6,;6.29,-8.41,;4.93,-7.69,;4.88,-6.15,;3.52,-5.42,;2.21,-6.24,;3.47,-3.88,;2.1,-3.15,;.64,-3.65,;-.62,-2.76,;-1.85,-3.68,;-1.35,-5.15,;-2.08,-6.49,;-1.28,-7.8,;.26,-7.76,;.99,-6.41,;.19,-5.12,;4.78,-3.07,;6.1,-3.3,;7.43,-4.09,;4.73,-1.52,;3.37,-.8,;3.32,.74,;1.96,1.47,;1.91,3.01,;.54,3.73,;.5,5.28,;-.76,2.92,;6.03,-.71,;7.4,-1.43,;7.45,-2.98,;8.71,-.62,;8.66,.92,;7.3,1.65,;7.25,3.18,;5.89,3.91,;4.58,3.1,;4.63,1.55,;5.98,.83,;10.06,-1.35,;11.38,-.54,;11.33,1.01,;12.75,-1.27,;13.83,-.17,;15.32,-.56,;15.32,-2.1,;12.78,-2.79,;14.15,-3.53,;15.45,-2.72,;16.54,.37,;16.34,1.9,;14.92,2.5,;17.57,2.84,;3.63,-8.5,;2.26,-7.78,;3.67,-10.04,)| Show InChI InChI=1S/C50H72N16O9/c1-3-4-16-35(59-28(2)67)43(70)65-39-25-41(68)56-20-11-10-18-34(42(51)69)61-46(73)38(23-30-26-58-33-17-9-8-15-32(30)33)63-44(71)36(19-12-21-57-49(52)53)62-45(72)37(22-29-13-6-5-7-14-29)64-47(74)40-24-31(60-50(54)55)27-66(40)48(39)75/h5-9,13-15,17,26,31,34-40,58H,3-4,10-12,16,18-25,27H2,1-2H3,(H2,51,69)(H,56,68)(H,59,67)(H,61,73)(H,62,72)(H,63,71)(H,64,74)(H,65,70)(H4,52,53,57)(H4,54,55,60)/t31-,34+,35+,36+,37-,38+,39+,40+/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
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PC sid
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| Article
PubMed
| n/a | n/a | n/a | n/a | 14 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC3R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268793
(Ac-Nle-c[Asp-His-DPhe-trans-4-guanidinyl-Pro-Trp-L...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.76,12.11,41.72,4.4,39.45,wD:57.61,25.25,(17.82,-24,;16.46,-23.28,;16.41,-21.74,;15.05,-21.01,;15,-19.47,;16.31,-18.66,;16.26,-17.12,;17.56,-16.31,;14.9,-16.39,;13.64,-18.75,;13.59,-17.21,;12.33,-19.56,;10.98,-18.84,;9.67,-19.65,;9.72,-21.19,;11.08,-21.91,;8.41,-22,;7.05,-21.28,;5.75,-22.09,;4.39,-21.37,;3.08,-22.18,;1.72,-21.45,;1.67,-19.91,;.31,-19.19,;-1,-20,;.26,-17.65,;-1.1,-16.92,;-1.15,-15.39,;.08,-14.44,;-.45,-12.99,;-2,-13.05,;-3.06,-11.95,;-4.55,-12.33,;-4.96,-13.81,;-3.88,-14.9,;-2.41,-14.52,;1.57,-16.84,;2.22,-17.92,;2.54,-19.47,;2.93,-17.56,;3.55,-19.14,;5.08,-19.09,;5.51,-17.61,;4.23,-16.75,;4.18,-15.21,;2.82,-14.48,;5.49,-14.4,;5.44,-12.86,;4.08,-12.13,;4.03,-10.59,;2.68,-9.87,;1.37,-10.68,;1.42,-12.23,;2.78,-12.95,;6.85,-15.12,;8.16,-14.31,;8.11,-12.77,;9.51,-15.03,;10.82,-14.22,;10.78,-12.68,;12,-11.74,;11.49,-10.29,;9.95,-10.33,;9.51,-11.81,;9.57,-16.57,;10.92,-17.3,;12.23,-16.48,;6.03,-20.31,;7.52,-19.93,;8.28,-20.74,;8.13,-18.67,;.41,-22.27,;-.95,-21.54,;.46,-23.81,)| Show InChI InChI=1S/C50H67N15O9/c1-3-4-15-36(58-28(2)66)44(69)62-39-23-42(67)55-18-11-10-17-35(43(51)68)60-45(70)37(20-30-24-56-34-16-9-8-14-33(30)34)63-48(73)41-22-32(59-50(52)53)26-65(41)49(74)40(19-29-12-6-5-7-13-29)64-46(71)38(61-47(39)72)21-31-25-54-27-57-31/h5-9,12-14,16,24-25,27,32,35-41,56H,3-4,10-11,15,17-23,26H2,1-2H3,(H2,51,68)(H,54,57)(H,55,67)(H,58,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)(H4,52,53,59)/t32-,35-,36-,37-,38-,39-,40+,41-/m0/s1 | PDB
KEGG
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| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268801
(Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DNal(2')-Arg-T...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,12.11,67.77,21.81,50.52,wD:25.25,39.41,65.73,(14,-47.54,;12.64,-46.82,;12.59,-45.28,;11.23,-44.55,;11.18,-43.02,;12.48,-42.2,;12.43,-40.66,;13.74,-39.85,;11.08,-39.94,;9.82,-42.29,;9.77,-40.75,;8.51,-43.1,;7.15,-42.38,;5.85,-43.19,;5.9,-44.73,;7.25,-45.46,;4.58,-45.55,;3.23,-44.82,;1.92,-45.64,;.56,-44.9,;-.75,-45.72,;-2.1,-44.99,;-2.16,-43.45,;-3.51,-42.73,;-4.83,-43.54,;-3.56,-41.19,;-4.94,-40.46,;-6.39,-40.96,;-7.65,-40.07,;-8.88,-40.99,;-8.38,-42.46,;-9.11,-43.8,;-8.32,-45.1,;-6.78,-45.06,;-6.05,-43.72,;-6.84,-42.42,;-2.26,-40.37,;-.94,-40.6,;.38,-41.4,;-2.31,-38.83,;-3.67,-38.11,;-3.72,-36.57,;-5.08,-35.85,;-5.13,-34.31,;-6.49,-33.58,;-6.54,-32.04,;-7.8,-34.4,;-1,-38.02,;.36,-38.75,;.41,-40.29,;1.67,-37.93,;1.61,-36.39,;.26,-35.67,;-1.06,-36.48,;-2.41,-35.77,;-2.46,-34.22,;-3.82,-33.49,;-3.87,-31.96,;-2.55,-31.14,;-1.19,-31.87,;-1.15,-33.41,;.21,-34.13,;3.02,-38.66,;4.34,-37.85,;4.28,-36.3,;5.7,-38.58,;6.78,-37.48,;8.27,-37.87,;8.27,-39.41,;5.74,-40.1,;7.1,-40.84,;8.41,-40.03,;9.5,-36.94,;9.3,-35.41,;7.88,-34.82,;10.52,-34.48,;-3.41,-45.81,;-4.77,-45.08,;-3.37,-47.35,)| Show InChI InChI=1S/C54H74N16O9/c1-3-4-15-39(63-30(2)71)47(74)69-43-27-45(72)60-21-10-9-17-38(46(55)73)65-50(77)42(25-34-28-62-37-16-8-7-14-36(34)37)67-48(75)40(18-11-22-61-53(56)57)66-49(76)41(24-31-19-20-32-12-5-6-13-33(32)23-31)68-51(78)44-26-35(64-54(58)59)29-70(44)52(43)79/h5-8,12-14,16,19-20,23,28,35,38-44,62H,3-4,9-11,15,17-18,21-22,24-27,29H2,1-2H3,(H2,55,73)(H,60,72)(H,63,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,56,57,61)(H4,58,59,64)/t35-,38+,39+,40+,41-,42+,43+,44+/m1/s1 | PDB
KEGG
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PC cid
PC sid
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| Article
PubMed
| n/a | n/a | n/a | n/a | 200 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC4R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268794
(Ac-Nle-c[Asp-His-DPhe-cis-4-guanidinyl-Pro-Trp-Lys...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.76,12.11,41.72,4.4,wD:57.61,25.25,39.45,(20.33,-40.8,;18.97,-40.08,;18.92,-38.54,;17.56,-37.81,;17.51,-36.27,;18.82,-35.46,;18.77,-33.92,;20.08,-33.11,;17.41,-33.19,;16.15,-35.55,;16.1,-34.01,;14.85,-36.36,;13.49,-35.64,;12.18,-36.45,;12.23,-37.99,;13.59,-38.71,;10.92,-38.8,;9.56,-38.08,;8.26,-38.89,;6.9,-38.17,;5.59,-38.98,;4.23,-38.25,;4.18,-36.71,;2.82,-35.99,;1.52,-36.8,;2.77,-34.45,;1.41,-33.72,;1.36,-32.19,;2.59,-31.24,;2.06,-29.79,;.52,-29.85,;-.55,-28.75,;-2.04,-29.13,;-2.45,-30.61,;-1.37,-31.7,;.1,-31.32,;4.08,-33.64,;4.74,-34.72,;5.06,-36.27,;5.44,-34.36,;6.06,-35.94,;7.6,-35.89,;8.02,-34.41,;6.75,-33.55,;6.7,-32.01,;5.34,-31.28,;8,-31.2,;7.95,-29.66,;6.59,-28.93,;6.55,-27.39,;5.19,-26.67,;3.88,-27.48,;3.94,-29.03,;5.29,-29.75,;9.36,-31.92,;10.67,-31.11,;10.62,-29.57,;12.03,-31.83,;13.33,-31.02,;13.29,-29.48,;14.51,-28.54,;14,-27.09,;12.46,-27.13,;12.02,-28.61,;12.08,-33.37,;13.44,-34.1,;14.74,-33.28,;8.54,-37.11,;10.04,-36.73,;10.8,-37.54,;10.65,-35.47,;2.93,-39.07,;1.57,-38.34,;2.98,-40.61,)| Show InChI InChI=1S/C50H67N15O9/c1-3-4-15-36(58-28(2)66)44(69)62-39-23-42(67)55-18-11-10-17-35(43(51)68)60-45(70)37(20-30-24-56-34-16-9-8-14-33(30)34)63-48(73)41-22-32(59-50(52)53)26-65(41)49(74)40(19-29-12-6-5-7-13-29)64-46(71)38(61-47(39)72)21-31-25-54-27-57-31/h5-9,12-14,16,24-25,27,32,35-41,56H,3-4,10-11,15,17-23,26H2,1-2H3,(H2,51,68)(H,54,57)(H,55,67)(H,58,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)(H4,52,53,59)/t32-,35-,36-,37-,38-,39-,40+,41+/m0/s1 | PDB
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PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268794
(Ac-Nle-c[Asp-His-DPhe-cis-4-guanidinyl-Pro-Trp-Lys...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.76,12.11,41.72,4.4,wD:57.61,25.25,39.45,(20.33,-40.8,;18.97,-40.08,;18.92,-38.54,;17.56,-37.81,;17.51,-36.27,;18.82,-35.46,;18.77,-33.92,;20.08,-33.11,;17.41,-33.19,;16.15,-35.55,;16.1,-34.01,;14.85,-36.36,;13.49,-35.64,;12.18,-36.45,;12.23,-37.99,;13.59,-38.71,;10.92,-38.8,;9.56,-38.08,;8.26,-38.89,;6.9,-38.17,;5.59,-38.98,;4.23,-38.25,;4.18,-36.71,;2.82,-35.99,;1.52,-36.8,;2.77,-34.45,;1.41,-33.72,;1.36,-32.19,;2.59,-31.24,;2.06,-29.79,;.52,-29.85,;-.55,-28.75,;-2.04,-29.13,;-2.45,-30.61,;-1.37,-31.7,;.1,-31.32,;4.08,-33.64,;4.74,-34.72,;5.06,-36.27,;5.44,-34.36,;6.06,-35.94,;7.6,-35.89,;8.02,-34.41,;6.75,-33.55,;6.7,-32.01,;5.34,-31.28,;8,-31.2,;7.95,-29.66,;6.59,-28.93,;6.55,-27.39,;5.19,-26.67,;3.88,-27.48,;3.94,-29.03,;5.29,-29.75,;9.36,-31.92,;10.67,-31.11,;10.62,-29.57,;12.03,-31.83,;13.33,-31.02,;13.29,-29.48,;14.51,-28.54,;14,-27.09,;12.46,-27.13,;12.02,-28.61,;12.08,-33.37,;13.44,-34.1,;14.74,-33.28,;8.54,-37.11,;10.04,-36.73,;10.8,-37.54,;10.65,-35.47,;2.93,-39.07,;1.57,-38.34,;2.98,-40.61,)| Show InChI InChI=1S/C50H67N15O9/c1-3-4-15-36(58-28(2)66)44(69)62-39-23-42(67)55-18-11-10-17-35(43(51)68)60-45(70)37(20-30-24-56-34-16-9-8-14-33(30)34)63-48(73)41-22-32(59-50(52)53)26-65(41)49(74)40(19-29-12-6-5-7-13-29)64-46(71)38(61-47(39)72)21-31-25-54-27-57-31/h5-9,12-14,16,24-25,27,32,35-41,56H,3-4,10-11,15,17-23,26H2,1-2H3,(H2,51,68)(H,54,57)(H,55,67)(H,58,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)(H4,52,53,59)/t32-,35-,36-,37-,38-,39-,40+,41+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC3R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268800
(Ac-Nle-c[Asp-His-DNal(2')-cis-4-guanidinyl-Pro-Trp...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.81,12.11,4.4,39.45,wD:61.66,25.25,41.77,(17.08,-28.2,;15.72,-27.49,;15.65,-25.95,;14.29,-25.23,;14.22,-23.7,;15.52,-22.87,;15.46,-21.33,;16.76,-20.51,;14.09,-20.62,;12.85,-22.98,;12.79,-21.44,;11.56,-23.81,;10.19,-23.09,;8.89,-23.93,;8.95,-25.47,;10.32,-26.17,;7.66,-26.29,;6.29,-25.58,;4.99,-26.4,;3.62,-25.69,;2.33,-26.52,;.96,-25.8,;.9,-24.26,;-.47,-23.55,;-1.77,-24.38,;-.53,-22.01,;-1.9,-21.3,;-1.97,-19.76,;-.75,-18.81,;-1.29,-17.36,;-2.83,-17.43,;-3.91,-16.34,;-5.39,-16.73,;-5.79,-18.22,;-4.71,-19.3,;-3.24,-18.91,;.77,-21.19,;1.43,-22.26,;1.77,-23.81,;2.13,-21.9,;2.76,-23.47,;4.3,-23.41,;4.72,-21.93,;3.43,-21.07,;3.37,-19.54,;2,-18.82,;4.67,-18.71,;4.6,-17.17,;3.24,-16.46,;1.94,-17.29,;.57,-16.58,;.5,-15.04,;-.85,-14.32,;-.92,-12.79,;.39,-11.96,;1.75,-12.68,;1.81,-14.22,;3.17,-14.92,;6.03,-19.42,;7.33,-18.6,;7.26,-17.05,;8.7,-19.3,;10,-18.48,;9.94,-16.94,;11.15,-15.99,;10.63,-14.55,;9.09,-14.6,;8.66,-16.08,;8.76,-20.84,;10.13,-21.56,;11.43,-20.73,;5.25,-24.61,;6.76,-24.38,;7.52,-24.99,;7.32,-22.97,;-.34,-26.63,;-1.71,-25.91,;-.27,-28.17,)| Show InChI InChI=1S/C54H69N15O9/c1-3-4-14-40(62-30(2)70)48(73)66-43-25-46(71)59-19-10-9-16-39(47(55)72)64-49(74)41(22-34-26-60-38-15-8-7-13-37(34)38)67-52(77)45-24-36(63-54(56)57)28-69(45)53(78)44(21-31-17-18-32-11-5-6-12-33(32)20-31)68-50(75)42(65-51(43)76)23-35-27-58-29-61-35/h5-8,11-13,15,17-18,20,26-27,29,36,39-45,60H,3-4,9-10,14,16,19,21-25,28H2,1-2H3,(H2,55,72)(H,58,61)(H,59,71)(H,62,70)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,75)(H4,56,57,63)/t36-,39+,40+,41+,42+,43+,44-,45+/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
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PC sid
UniChem
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| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC3R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268801
(Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DNal(2')-Arg-T...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,12.11,67.77,21.81,50.52,wD:25.25,39.41,65.73,(14,-47.54,;12.64,-46.82,;12.59,-45.28,;11.23,-44.55,;11.18,-43.02,;12.48,-42.2,;12.43,-40.66,;13.74,-39.85,;11.08,-39.94,;9.82,-42.29,;9.77,-40.75,;8.51,-43.1,;7.15,-42.38,;5.85,-43.19,;5.9,-44.73,;7.25,-45.46,;4.58,-45.55,;3.23,-44.82,;1.92,-45.64,;.56,-44.9,;-.75,-45.72,;-2.1,-44.99,;-2.16,-43.45,;-3.51,-42.73,;-4.83,-43.54,;-3.56,-41.19,;-4.94,-40.46,;-6.39,-40.96,;-7.65,-40.07,;-8.88,-40.99,;-8.38,-42.46,;-9.11,-43.8,;-8.32,-45.1,;-6.78,-45.06,;-6.05,-43.72,;-6.84,-42.42,;-2.26,-40.37,;-.94,-40.6,;.38,-41.4,;-2.31,-38.83,;-3.67,-38.11,;-3.72,-36.57,;-5.08,-35.85,;-5.13,-34.31,;-6.49,-33.58,;-6.54,-32.04,;-7.8,-34.4,;-1,-38.02,;.36,-38.75,;.41,-40.29,;1.67,-37.93,;1.61,-36.39,;.26,-35.67,;-1.06,-36.48,;-2.41,-35.77,;-2.46,-34.22,;-3.82,-33.49,;-3.87,-31.96,;-2.55,-31.14,;-1.19,-31.87,;-1.15,-33.41,;.21,-34.13,;3.02,-38.66,;4.34,-37.85,;4.28,-36.3,;5.7,-38.58,;6.78,-37.48,;8.27,-37.87,;8.27,-39.41,;5.74,-40.1,;7.1,-40.84,;8.41,-40.03,;9.5,-36.94,;9.3,-35.41,;7.88,-34.82,;10.52,-34.48,;-3.41,-45.81,;-4.77,-45.08,;-3.37,-47.35,)| Show InChI InChI=1S/C54H74N16O9/c1-3-4-15-39(63-30(2)71)47(74)69-43-27-45(72)60-21-10-9-17-38(46(55)73)65-50(77)42(25-34-28-62-37-16-8-7-14-36(34)37)67-48(75)40(18-11-22-61-53(56)57)66-49(76)41(24-31-19-20-32-12-5-6-13-33(32)23-31)68-51(78)44-26-35(64-54(58)59)29-70(44)52(43)79/h5-8,12-14,16,19-20,23,28,35,38-44,62H,3-4,9-11,15,17-18,21-22,24-27,29H2,1-2H3,(H2,55,73)(H,60,72)(H,63,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,56,57,61)(H4,58,59,64)/t35-,38+,39+,40+,41-,42+,43+,44+/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 130 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC3R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268803
(Ac-Tyr-Val-Nle-Gly-His-DPhe-cis-Xaa-Trp-Asp-Arg-Ph...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O)N=C(N)N |r,wU:8.8,45.46,59.63,57.117,96.101,35.35,77.82,wD:4.4,12.21,63.66,85.90,(2.53,-50.05,;1.21,-50.83,;-.13,-50.07,;-1.45,-50.85,;-2.8,-50.09,;-4.13,-50.88,;-4.11,-52.42,;-2.77,-53.17,;-5.44,-53.2,;-5.43,-54.75,;-6.75,-55.53,;-8.09,-54.77,;-6.74,-57.06,;-5.4,-57.82,;-4.07,-57.04,;-4.09,-55.5,;-2.76,-54.71,;-1.41,-55.47,;-.08,-54.68,;-1.39,-57.02,;-2.73,-57.8,;-8.07,-57.85,;-8.06,-59.39,;-9.38,-60.18,;-6.71,-60.14,;-6.78,-52.45,;-6.8,-50.91,;-8.1,-53.23,;-2.82,-48.56,;-4.16,-47.8,;-1.49,-47.77,;-1.51,-46.23,;-.18,-45.44,;1.17,-46.2,;-.2,-43.9,;1.13,-43.12,;1.11,-41.58,;-.23,-40.83,;-.4,-39.3,;-1.91,-38.99,;-2.66,-40.33,;-1.63,-41.47,;2.47,-43.88,;2.49,-45.42,;3.8,-43.1,;5.14,-43.85,;5.16,-45.4,;6.5,-46.15,;6.51,-47.7,;7.85,-48.46,;9.17,-47.68,;9.16,-46.14,;7.81,-45.37,;6.5,-43.14,;7.76,-44.04,;6.57,-41.61,;5.55,-40.45,;6.33,-39.12,;7.84,-39.46,;7.99,-40.99,;9.31,-41.78,;9.3,-43.32,;10.65,-41.02,;11.97,-41.82,;11.95,-43.36,;13.23,-44.22,;14.68,-43.68,;15.63,-44.89,;14.78,-46.18,;15.16,-47.67,;14.06,-48.75,;12.58,-48.33,;12.19,-46.84,;13.3,-45.76,;13.31,-41.06,;13.32,-39.52,;14.64,-41.85,;15.98,-41.1,;15.99,-39.56,;17.33,-38.8,;18.67,-39.57,;17.35,-37.26,;17.3,-41.87,;17.29,-43.42,;18.65,-41.12,;19.96,-41.91,;19.94,-43.46,;21.27,-44.24,;21.26,-45.78,;22.59,-46.55,;22.56,-48.09,;21.24,-48.84,;23.9,-48.86,;21.3,-41.16,;21.31,-39.62,;22.64,-41.93,;23.98,-41.17,;23.99,-39.64,;25.33,-38.88,;26.66,-39.66,;28.01,-38.91,;28.02,-37.37,;26.7,-36.58,;25.36,-37.34,;25.31,-41.95,;25.29,-43.5,;26.65,-41.2,;27.97,-41.99,;29.31,-41.23,;30.64,-42.01,;29.32,-39.69,;5.72,-37.71,;6.64,-36.47,;6.03,-35.06,;8.17,-36.65,)| Show InChI InChI=1S/C77H102N22O16/c1-5-6-21-53(93-74(114)65(42(2)3)98-72(112)56(89-43(4)100)30-46-24-26-50(101)27-25-46)66(106)87-39-63(103)91-58(33-48-37-83-41-88-48)70(110)97-60(31-45-18-11-8-12-19-45)75(115)99-40-49(90-77(81)82)34-61(99)73(113)96-57(32-47-36-85-52-22-14-13-20-51(47)52)69(109)95-59(35-64(104)105)71(111)92-54(23-15-28-84-76(79)80)68(108)94-55(67(107)86-38-62(78)102)29-44-16-9-7-10-17-44/h7-14,16-20,22,24-27,36-37,41-42,49,53-61,65,85,101H,5-6,15,21,23,28-35,38-40H2,1-4H3,(H2,78,102)(H,83,88)(H,86,107)(H,87,106)(H,89,100)(H,91,103)(H,92,111)(H,93,114)(H,94,108)(H,95,109)(H,96,113)(H,97,110)(H,98,112)(H,104,105)(H4,79,80,84)(H4,81,82,90)/t49-,53-,54-,55-,56-,57-,58-,59-,60+,61-,65-/m0/s1 | PDB
KEGG
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PC cid
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UniChem
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PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC4R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268806
(Ac-Tyr-Val-Nle-Gly-His-DPhe-Arg-Trp-Asp-Arg-Phe-Gl...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r,wU:12.21,56.58,35.35,81.85,45.46,4.4,100.104,wD:67.69,8.8,89.93,(6.82,-32.01,;5.49,-32.78,;5.49,-34.31,;4.16,-35.09,;4.16,-36.62,;2.82,-37.38,;1.49,-36.61,;1.49,-35.08,;.16,-37.38,;-1.17,-36.62,;-2.5,-37.4,;-2.5,-38.94,;-3.83,-36.63,;-3.83,-35.09,;-2.49,-34.32,;-1.16,-35.09,;.18,-34.32,;.18,-32.78,;1.51,-32,;-1.15,-32.01,;-2.49,-32.78,;-5.18,-37.37,;-6.51,-36.6,;-7.85,-37.37,;-6.51,-35.06,;.16,-38.93,;1.49,-39.69,;-1.18,-39.7,;5.49,-37.39,;5.49,-38.94,;6.83,-36.63,;8.16,-37.4,;9.49,-36.63,;9.49,-35.09,;10.83,-37.4,;12.17,-36.64,;12.17,-35.1,;13.5,-34.33,;14.91,-34.96,;15.95,-33.81,;15.17,-32.48,;13.66,-32.79,;13.5,-37.41,;13.5,-38.95,;14.83,-36.63,;16.17,-37.4,;16.17,-38.95,;17.5,-39.71,;18.84,-38.95,;20.17,-39.72,;20.17,-41.26,;18.83,-42.03,;17.5,-41.26,;17.5,-36.63,;17.5,-35.1,;18.83,-37.4,;20.18,-36.65,;20.18,-35.11,;21.51,-34.34,;21.51,-32.81,;22.84,-32.03,;22.85,-30.49,;21.51,-29.71,;24.18,-29.72,;21.51,-37.42,;21.51,-38.97,;22.84,-36.64,;24.17,-37.41,;24.17,-38.95,;25.5,-39.72,;26.91,-39.1,;27.94,-40.24,;27.17,-41.58,;27.64,-43.04,;26.61,-44.18,;25.1,-43.86,;24.63,-42.39,;25.66,-41.25,;25.5,-36.64,;25.5,-35.1,;26.84,-37.41,;28.17,-36.64,;28.17,-35.11,;29.5,-34.34,;30.83,-35.11,;29.5,-32.8,;29.5,-37.42,;29.5,-38.96,;30.84,-36.64,;32.17,-37.41,;32.17,-38.96,;33.49,-39.72,;33.49,-41.27,;34.82,-42.04,;34.83,-43.58,;33.49,-44.35,;36.16,-44.35,;33.49,-36.64,;33.49,-35.11,;34.83,-37.41,;36.16,-36.64,;36.16,-35.1,;37.5,-34.34,;38.83,-35.11,;40.16,-34.34,;40.17,-32.8,;38.84,-32.03,;37.5,-32.79,;37.5,-37.42,;37.5,-38.95,;38.83,-36.64,;40.16,-37.41,;41.48,-36.64,;42.83,-37.42,;41.48,-35.11,)| Show InChI InChI=1S/C77H104N22O16/c1-5-6-22-53(94-75(115)65(43(2)3)99-74(114)57(90-44(4)100)34-47-26-28-50(101)29-27-47)66(106)88-41-63(103)91-60(36-49-39-83-42-89-49)72(112)96-58(33-46-19-11-8-12-20-46)70(110)92-55(25-16-31-85-77(81)82)69(109)97-59(35-48-38-86-52-23-14-13-21-51(48)52)71(111)98-61(37-64(104)105)73(113)93-54(24-15-30-84-76(79)80)68(108)95-56(67(107)87-40-62(78)102)32-45-17-9-7-10-18-45/h7-14,17-21,23,26-29,38-39,42-43,53-61,65,86,101H,5-6,15-16,22,24-25,30-37,40-41H2,1-4H3,(H2,78,102)(H,83,89)(H,87,107)(H,88,106)(H,90,100)(H,91,103)(H,92,110)(H,93,113)(H,94,115)(H,95,108)(H,96,112)(H,97,109)(H,98,111)(H,99,114)(H,104,105)(H4,79,80,84)(H4,81,82,85)/t53-,54-,55-,56-,57-,58+,59-,60-,61-,65-/m0/s1 | PDB
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antibodypedia
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PC cid
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UniChem
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PubMed
| n/a | n/a | n/a | n/a | 1.90 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268796
(Ac-Nle-c[Asp-cis-4-guanidinyl-Pro-DPhe-Arg-Trp-Lys...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,12.11,21.76,wD:25.25,39.41,61.68,63.72,(20.34,-25.22,;18.98,-24.49,;18.93,-22.95,;17.57,-22.23,;17.52,-20.69,;18.83,-19.87,;18.78,-18.33,;20.08,-17.51,;17.42,-17.6,;16.16,-19.96,;16.11,-18.42,;14.85,-20.77,;13.49,-20.05,;12.18,-20.86,;12.24,-22.4,;13.59,-23.13,;10.92,-23.22,;9.56,-22.49,;8.26,-23.31,;6.89,-22.58,;5.58,-23.39,;4.23,-22.66,;4.17,-21.12,;2.82,-20.4,;1.5,-21.21,;2.76,-18.86,;1.39,-18.12,;-.07,-18.63,;-1.33,-17.73,;-2.56,-18.65,;-2.05,-20.13,;-2.79,-21.47,;-1.99,-22.78,;-.45,-22.73,;.28,-21.39,;-.52,-20.09,;4.07,-18.04,;5.39,-18.27,;6.72,-19.07,;4.02,-16.5,;2.66,-15.78,;2.61,-14.23,;1.25,-13.51,;1.2,-11.97,;-.17,-11.24,;-.21,-9.7,;-1.47,-12.06,;5.33,-15.69,;6.69,-16.41,;6.74,-17.95,;8,-15.6,;7.95,-14.06,;6.59,-13.33,;6.54,-11.79,;5.18,-11.07,;3.87,-11.88,;3.92,-13.43,;5.27,-14.15,;9.36,-16.32,;10.67,-15.52,;10.62,-13.97,;12.04,-16.25,;13.12,-15.14,;14.62,-15.54,;14.61,-17.08,;12.07,-17.77,;13.44,-18.51,;14.75,-17.69,;15.84,-14.61,;15.64,-13.08,;14.21,-12.48,;16.87,-12.14,;2.92,-23.48,;1.55,-22.75,;2.96,-25.02,)| Show InChI InChI=1S/C50H72N16O9/c1-3-4-16-35(59-28(2)67)43(70)65-39-25-41(68)56-20-11-10-18-34(42(51)69)61-46(73)38(23-30-26-58-33-17-9-8-15-32(30)33)63-44(71)36(19-12-21-57-49(52)53)62-45(72)37(22-29-13-6-5-7-14-29)64-47(74)40-24-31(60-50(54)55)27-66(40)48(39)75/h5-9,13-15,17,26,31,34-40,58H,3-4,10-12,16,18-25,27H2,1-2H3,(H2,51,69)(H,56,68)(H,59,67)(H,61,73)(H,62,72)(H,63,71)(H,64,74)(H,65,70)(H4,52,53,57)(H4,54,55,60)/t31-,34-,35-,36-,37+,38-,39-,40-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 21 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268804
(Ac-Tyr-Val-Nle-Gly-His-DPhe-Pro-Trp-Asp-Arg-Phe-Gl...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r,wU:8.8,45.46,59.63,96.101,35.35,77.82,wD:4.4,12.21,63.66,85.90,(2.68,-6.73,;1.36,-7.52,;.01,-6.75,;-1.31,-7.53,;-2.65,-6.78,;-3.99,-7.57,;-3.97,-9.11,;-2.62,-9.86,;-5.3,-9.89,;-5.28,-11.43,;-6.61,-12.22,;-7.94,-11.46,;-6.59,-13.75,;-5.25,-14.51,;-3.92,-13.72,;-3.94,-12.19,;-2.61,-11.4,;-1.26,-12.16,;.06,-11.37,;-1.25,-13.71,;-2.58,-14.49,;-7.92,-14.54,;-7.92,-16.08,;-9.23,-16.86,;-6.56,-16.83,;-6.64,-9.14,;-6.65,-7.59,;-7.95,-9.92,;-2.67,-5.24,;-4.01,-4.49,;-1.35,-4.46,;-1.37,-2.92,;-.03,-2.13,;1.32,-2.89,;-.05,-.59,;1.27,.2,;1.26,1.73,;-.08,2.49,;-.25,4.02,;-1.77,4.33,;-2.52,2.99,;-1.48,1.85,;2.62,-.57,;2.64,-2.11,;3.94,.22,;5.29,-.54,;5.31,-2.09,;6.64,-2.84,;6.66,-4.39,;8,-5.15,;9.32,-4.36,;9.3,-2.82,;7.96,-2.06,;6.65,.17,;7.9,-.73,;6.72,1.71,;5.7,2.87,;6.48,4.19,;7.98,3.86,;8.13,2.32,;9.45,1.54,;9.44,-0,;10.8,2.29,;12.11,1.49,;12.1,-.05,;13.38,-.9,;14.82,-.37,;15.78,-1.58,;14.93,-2.86,;15.31,-4.35,;14.21,-5.43,;12.73,-5.02,;12.34,-3.52,;13.44,-2.45,;13.46,2.25,;13.47,3.79,;14.78,1.46,;16.13,2.22,;16.14,3.76,;17.48,4.52,;18.82,3.75,;17.5,6.06,;17.45,1.44,;17.43,-.1,;18.79,2.2,;20.11,1.4,;20.09,-.14,;21.42,-.92,;21.41,-2.46,;22.74,-3.24,;22.71,-4.78,;21.38,-5.53,;24.05,-5.55,;21.45,2.16,;21.46,3.7,;22.79,1.39,;24.13,2.15,;24.14,3.68,;25.48,4.44,;26.81,3.66,;28.16,4.41,;28.17,5.95,;26.84,6.74,;25.51,5.98,;25.46,1.36,;25.44,-.18,;26.8,2.12,;28.12,1.33,;29.46,2.09,;30.79,1.3,;29.47,3.63,)| Show InChI InChI=1S/C76H99N19O16/c1-5-6-22-53(89-74(110)65(43(2)3)94-72(108)56(86-44(4)96)33-47-26-28-50(97)29-27-47)66(102)84-41-63(99)87-58(36-49-39-80-42-85-49)70(106)93-60(34-46-19-11-8-12-20-46)75(111)95-31-16-25-61(95)73(109)92-57(35-48-38-82-52-23-14-13-21-51(48)52)69(105)91-59(37-64(100)101)71(107)88-54(24-15-30-81-76(78)79)68(104)90-55(67(103)83-40-62(77)98)32-45-17-9-7-10-18-45/h7-14,17-21,23,26-29,38-39,42-43,53-61,65,82,97H,5-6,15-16,22,24-25,30-37,40-41H2,1-4H3,(H2,77,98)(H,80,85)(H,83,103)(H,84,102)(H,86,96)(H,87,99)(H,88,107)(H,89,110)(H,90,104)(H,91,105)(H,92,109)(H,93,106)(H,94,108)(H,100,101)(H4,78,79,81)/t53-,54-,55-,56-,57-,58-,59-,60+,61-,65-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 210 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC4R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268802
(Ac-Nle-c[Asp-cis-4-guanidinyl-Pro-DNal(2')-Arg-Trp...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2C[C@@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,12.11,21.81,50.52,wD:25.25,39.41,65.73,67.77,(39.57,-47.74,;38.21,-47.02,;38.16,-45.48,;36.8,-44.75,;36.75,-43.21,;38.06,-42.4,;38,-40.86,;39.31,-40.04,;36.65,-40.13,;35.39,-42.49,;35.34,-40.95,;34.08,-43.3,;32.72,-42.58,;31.42,-43.39,;31.47,-44.93,;32.83,-45.65,;30.16,-45.74,;28.8,-45.02,;27.49,-45.83,;26.13,-45.1,;24.82,-45.91,;23.47,-45.19,;23.42,-43.65,;22.06,-42.92,;20.75,-43.74,;22.01,-41.38,;20.63,-40.65,;19.18,-41.16,;17.92,-40.26,;16.69,-41.18,;17.19,-42.65,;16.46,-44,;17.25,-45.3,;18.8,-45.26,;19.52,-43.91,;18.73,-42.62,;23.31,-40.57,;24.63,-40.8,;25.96,-41.59,;23.26,-39.03,;21.9,-38.31,;21.85,-36.77,;20.5,-36.04,;20.44,-34.5,;19.08,-33.78,;19.04,-32.24,;17.77,-34.59,;24.57,-38.22,;25.93,-38.94,;25.98,-40.48,;27.24,-38.13,;27.19,-36.59,;25.83,-35.86,;24.52,-36.68,;23.17,-35.96,;23.11,-34.42,;21.76,-33.69,;21.71,-32.15,;23.02,-31.33,;24.38,-32.07,;24.43,-33.61,;25.78,-34.33,;28.59,-38.85,;29.91,-38.05,;29.86,-36.5,;31.27,-38.78,;32.35,-37.67,;33.85,-38.07,;33.84,-39.61,;31.31,-40.3,;32.67,-41.04,;33.98,-40.22,;35.07,-37.14,;34.87,-35.61,;33.45,-35.01,;36.1,-34.67,;22.16,-46,;20.8,-45.28,;22.21,-47.54,)| Show InChI InChI=1S/C54H74N16O9/c1-3-4-15-39(63-30(2)71)47(74)69-43-27-45(72)60-21-10-9-17-38(46(55)73)65-50(77)42(25-34-28-62-37-16-8-7-14-36(34)37)67-48(75)40(18-11-22-61-53(56)57)66-49(76)41(24-31-19-20-32-12-5-6-13-33(32)23-31)68-51(78)44-26-35(64-54(58)59)29-70(44)52(43)79/h5-8,12-14,16,19-20,23,28,35,38-44,62H,3-4,9-11,15,17-18,21-22,24-27,29H2,1-2H3,(H2,55,73)(H,60,72)(H,63,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,56,57,61)(H4,58,59,64)/t35-,38-,39-,40-,41+,42-,43-,44-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.40E+3 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC4R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268795
(Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DPhe-Arg-Trp-L...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,63.72,12.11,21.76,wD:25.25,39.41,61.68,(21.05,-10.24,;19.69,-9.52,;19.64,-7.97,;18.28,-7.25,;18.23,-5.71,;19.54,-4.89,;19.48,-3.35,;20.79,-2.54,;18.13,-2.63,;16.87,-4.98,;16.82,-3.44,;15.56,-5.8,;14.2,-5.07,;12.89,-5.89,;12.94,-7.43,;14.3,-8.15,;11.63,-8.24,;10.27,-7.52,;8.96,-8.33,;7.6,-7.6,;6.29,-8.41,;4.93,-7.69,;4.88,-6.15,;3.52,-5.42,;2.21,-6.24,;3.47,-3.88,;2.1,-3.15,;.64,-3.65,;-.62,-2.76,;-1.85,-3.68,;-1.35,-5.15,;-2.08,-6.49,;-1.28,-7.8,;.26,-7.76,;.99,-6.41,;.19,-5.12,;4.78,-3.07,;6.1,-3.3,;7.43,-4.09,;4.73,-1.52,;3.37,-.8,;3.32,.74,;1.96,1.47,;1.91,3.01,;.54,3.73,;.5,5.28,;-.76,2.92,;6.03,-.71,;7.4,-1.43,;7.45,-2.98,;8.71,-.62,;8.66,.92,;7.3,1.65,;7.25,3.18,;5.89,3.91,;4.58,3.1,;4.63,1.55,;5.98,.83,;10.06,-1.35,;11.38,-.54,;11.33,1.01,;12.75,-1.27,;13.83,-.17,;15.32,-.56,;15.32,-2.1,;12.78,-2.79,;14.15,-3.53,;15.45,-2.72,;16.54,.37,;16.34,1.9,;14.92,2.5,;17.57,2.84,;3.63,-8.5,;2.26,-7.78,;3.67,-10.04,)| Show InChI InChI=1S/C50H72N16O9/c1-3-4-16-35(59-28(2)67)43(70)65-39-25-41(68)56-20-11-10-18-34(42(51)69)61-46(73)38(23-30-26-58-33-17-9-8-15-32(30)33)63-44(71)36(19-12-21-57-49(52)53)62-45(72)37(22-29-13-6-5-7-14-29)64-47(74)40-24-31(60-50(54)55)27-66(40)48(39)75/h5-9,13-15,17,26,31,34-40,58H,3-4,10-12,16,18-25,27H2,1-2H3,(H2,51,69)(H,56,68)(H,59,67)(H,61,73)(H,62,72)(H,63,71)(H,64,74)(H,65,70)(H4,52,53,57)(H4,54,55,60)/t31-,34+,35+,36+,37-,38+,39+,40+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.50E+3 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC4R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268792
(AC-Nle-c[Asp-His-DPhe-Pro-Trp-Lys]-NH2 | CHEMBL501...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r| Show InChI InChI=1S/C49H64N12O9/c1-3-4-16-36(55-29(2)62)44(65)58-39-25-42(63)52-20-11-10-18-35(43(50)64)56-45(66)37(23-31-26-53-34-17-9-8-15-33(31)34)59-48(69)41-19-12-21-61(41)49(70)40(22-30-13-6-5-7-14-30)60-46(67)38(57-47(39)68)24-32-27-51-28-54-32/h5-9,13-15,17,26-28,35-41,53H,3-4,10-12,16,18-25H2,1-2H3,(H2,50,64)(H,51,54)(H,52,63)(H,55,62)(H,56,66)(H,57,68)(H,58,65)(H,59,69)(H,60,67)/t35-,36-,37-,38-,39-,40+,41-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268793
(Ac-Nle-c[Asp-His-DPhe-trans-4-guanidinyl-Pro-Trp-L...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.76,12.11,41.72,4.4,39.45,wD:57.61,25.25,(17.82,-24,;16.46,-23.28,;16.41,-21.74,;15.05,-21.01,;15,-19.47,;16.31,-18.66,;16.26,-17.12,;17.56,-16.31,;14.9,-16.39,;13.64,-18.75,;13.59,-17.21,;12.33,-19.56,;10.98,-18.84,;9.67,-19.65,;9.72,-21.19,;11.08,-21.91,;8.41,-22,;7.05,-21.28,;5.75,-22.09,;4.39,-21.37,;3.08,-22.18,;1.72,-21.45,;1.67,-19.91,;.31,-19.19,;-1,-20,;.26,-17.65,;-1.1,-16.92,;-1.15,-15.39,;.08,-14.44,;-.45,-12.99,;-2,-13.05,;-3.06,-11.95,;-4.55,-12.33,;-4.96,-13.81,;-3.88,-14.9,;-2.41,-14.52,;1.57,-16.84,;2.22,-17.92,;2.54,-19.47,;2.93,-17.56,;3.55,-19.14,;5.08,-19.09,;5.51,-17.61,;4.23,-16.75,;4.18,-15.21,;2.82,-14.48,;5.49,-14.4,;5.44,-12.86,;4.08,-12.13,;4.03,-10.59,;2.68,-9.87,;1.37,-10.68,;1.42,-12.23,;2.78,-12.95,;6.85,-15.12,;8.16,-14.31,;8.11,-12.77,;9.51,-15.03,;10.82,-14.22,;10.78,-12.68,;12,-11.74,;11.49,-10.29,;9.95,-10.33,;9.51,-11.81,;9.57,-16.57,;10.92,-17.3,;12.23,-16.48,;6.03,-20.31,;7.52,-19.93,;8.28,-20.74,;8.13,-18.67,;.41,-22.27,;-.95,-21.54,;.46,-23.81,)| Show InChI InChI=1S/C50H67N15O9/c1-3-4-15-36(58-28(2)66)44(69)62-39-23-42(67)55-18-11-10-17-35(43(51)68)60-45(70)37(20-30-24-56-34-16-9-8-14-33(30)34)63-48(73)41-22-32(59-50(52)53)26-65(41)49(74)40(19-29-12-6-5-7-13-29)64-46(71)38(61-47(39)72)21-31-25-54-27-57-31/h5-9,12-14,16,24-25,27,32,35-41,56H,3-4,10-11,15,17-23,26H2,1-2H3,(H2,51,68)(H,54,57)(H,55,67)(H,58,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)(H4,52,53,59)/t32-,35-,36-,37-,38-,39-,40+,41-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC3R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268806
(Ac-Tyr-Val-Nle-Gly-His-DPhe-Arg-Trp-Asp-Arg-Phe-Gl...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r,wU:12.21,56.58,35.35,81.85,45.46,4.4,100.104,wD:67.69,8.8,89.93,(6.82,-32.01,;5.49,-32.78,;5.49,-34.31,;4.16,-35.09,;4.16,-36.62,;2.82,-37.38,;1.49,-36.61,;1.49,-35.08,;.16,-37.38,;-1.17,-36.62,;-2.5,-37.4,;-2.5,-38.94,;-3.83,-36.63,;-3.83,-35.09,;-2.49,-34.32,;-1.16,-35.09,;.18,-34.32,;.18,-32.78,;1.51,-32,;-1.15,-32.01,;-2.49,-32.78,;-5.18,-37.37,;-6.51,-36.6,;-7.85,-37.37,;-6.51,-35.06,;.16,-38.93,;1.49,-39.69,;-1.18,-39.7,;5.49,-37.39,;5.49,-38.94,;6.83,-36.63,;8.16,-37.4,;9.49,-36.63,;9.49,-35.09,;10.83,-37.4,;12.17,-36.64,;12.17,-35.1,;13.5,-34.33,;14.91,-34.96,;15.95,-33.81,;15.17,-32.48,;13.66,-32.79,;13.5,-37.41,;13.5,-38.95,;14.83,-36.63,;16.17,-37.4,;16.17,-38.95,;17.5,-39.71,;18.84,-38.95,;20.17,-39.72,;20.17,-41.26,;18.83,-42.03,;17.5,-41.26,;17.5,-36.63,;17.5,-35.1,;18.83,-37.4,;20.18,-36.65,;20.18,-35.11,;21.51,-34.34,;21.51,-32.81,;22.84,-32.03,;22.85,-30.49,;21.51,-29.71,;24.18,-29.72,;21.51,-37.42,;21.51,-38.97,;22.84,-36.64,;24.17,-37.41,;24.17,-38.95,;25.5,-39.72,;26.91,-39.1,;27.94,-40.24,;27.17,-41.58,;27.64,-43.04,;26.61,-44.18,;25.1,-43.86,;24.63,-42.39,;25.66,-41.25,;25.5,-36.64,;25.5,-35.1,;26.84,-37.41,;28.17,-36.64,;28.17,-35.11,;29.5,-34.34,;30.83,-35.11,;29.5,-32.8,;29.5,-37.42,;29.5,-38.96,;30.84,-36.64,;32.17,-37.41,;32.17,-38.96,;33.49,-39.72,;33.49,-41.27,;34.82,-42.04,;34.83,-43.58,;33.49,-44.35,;36.16,-44.35,;33.49,-36.64,;33.49,-35.11,;34.83,-37.41,;36.16,-36.64,;36.16,-35.1,;37.5,-34.34,;38.83,-35.11,;40.16,-34.34,;40.17,-32.8,;38.84,-32.03,;37.5,-32.79,;37.5,-37.42,;37.5,-38.95,;38.83,-36.64,;40.16,-37.41,;41.48,-36.64,;42.83,-37.42,;41.48,-35.11,)| Show InChI InChI=1S/C77H104N22O16/c1-5-6-22-53(94-75(115)65(43(2)3)99-74(114)57(90-44(4)100)34-47-26-28-50(101)29-27-47)66(106)88-41-63(103)91-60(36-49-39-83-42-89-49)72(112)96-58(33-46-19-11-8-12-20-46)70(110)92-55(25-16-31-85-77(81)82)69(109)97-59(35-48-38-86-52-23-14-13-21-51(48)52)71(111)98-61(37-64(104)105)73(113)93-54(24-15-30-84-76(79)80)68(108)95-56(67(107)87-40-62(78)102)32-45-17-9-7-10-18-45/h7-14,17-21,23,26-29,38-39,42-43,53-61,65,86,101H,5-6,15-16,22,24-25,30-37,40-41H2,1-4H3,(H2,78,102)(H,83,89)(H,87,107)(H,88,106)(H,90,100)(H,91,103)(H,92,110)(H,93,113)(H,94,115)(H,95,108)(H,96,112)(H,97,109)(H,98,111)(H,99,114)(H,104,105)(H4,79,80,84)(H4,81,82,85)/t53-,54-,55-,56-,57-,58+,59-,60-,61-,65-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.5 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268803
(Ac-Tyr-Val-Nle-Gly-His-DPhe-cis-Xaa-Trp-Asp-Arg-Ph...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O)N=C(N)N |r,wU:8.8,45.46,59.63,57.117,96.101,35.35,77.82,wD:4.4,12.21,63.66,85.90,(2.53,-50.05,;1.21,-50.83,;-.13,-50.07,;-1.45,-50.85,;-2.8,-50.09,;-4.13,-50.88,;-4.11,-52.42,;-2.77,-53.17,;-5.44,-53.2,;-5.43,-54.75,;-6.75,-55.53,;-8.09,-54.77,;-6.74,-57.06,;-5.4,-57.82,;-4.07,-57.04,;-4.09,-55.5,;-2.76,-54.71,;-1.41,-55.47,;-.08,-54.68,;-1.39,-57.02,;-2.73,-57.8,;-8.07,-57.85,;-8.06,-59.39,;-9.38,-60.18,;-6.71,-60.14,;-6.78,-52.45,;-6.8,-50.91,;-8.1,-53.23,;-2.82,-48.56,;-4.16,-47.8,;-1.49,-47.77,;-1.51,-46.23,;-.18,-45.44,;1.17,-46.2,;-.2,-43.9,;1.13,-43.12,;1.11,-41.58,;-.23,-40.83,;-.4,-39.3,;-1.91,-38.99,;-2.66,-40.33,;-1.63,-41.47,;2.47,-43.88,;2.49,-45.42,;3.8,-43.1,;5.14,-43.85,;5.16,-45.4,;6.5,-46.15,;6.51,-47.7,;7.85,-48.46,;9.17,-47.68,;9.16,-46.14,;7.81,-45.37,;6.5,-43.14,;7.76,-44.04,;6.57,-41.61,;5.55,-40.45,;6.33,-39.12,;7.84,-39.46,;7.99,-40.99,;9.31,-41.78,;9.3,-43.32,;10.65,-41.02,;11.97,-41.82,;11.95,-43.36,;13.23,-44.22,;14.68,-43.68,;15.63,-44.89,;14.78,-46.18,;15.16,-47.67,;14.06,-48.75,;12.58,-48.33,;12.19,-46.84,;13.3,-45.76,;13.31,-41.06,;13.32,-39.52,;14.64,-41.85,;15.98,-41.1,;15.99,-39.56,;17.33,-38.8,;18.67,-39.57,;17.35,-37.26,;17.3,-41.87,;17.29,-43.42,;18.65,-41.12,;19.96,-41.91,;19.94,-43.46,;21.27,-44.24,;21.26,-45.78,;22.59,-46.55,;22.56,-48.09,;21.24,-48.84,;23.9,-48.86,;21.3,-41.16,;21.31,-39.62,;22.64,-41.93,;23.98,-41.17,;23.99,-39.64,;25.33,-38.88,;26.66,-39.66,;28.01,-38.91,;28.02,-37.37,;26.7,-36.58,;25.36,-37.34,;25.31,-41.95,;25.29,-43.5,;26.65,-41.2,;27.97,-41.99,;29.31,-41.23,;30.64,-42.01,;29.32,-39.69,;5.72,-37.71,;6.64,-36.47,;6.03,-35.06,;8.17,-36.65,)| Show InChI InChI=1S/C77H102N22O16/c1-5-6-21-53(93-74(114)65(42(2)3)98-72(112)56(89-43(4)100)30-46-24-26-50(101)27-25-46)66(106)87-39-63(103)91-58(33-48-37-83-41-88-48)70(110)97-60(31-45-18-11-8-12-19-45)75(115)99-40-49(90-77(81)82)34-61(99)73(113)96-57(32-47-36-85-52-22-14-13-20-51(47)52)69(109)95-59(35-64(104)105)71(111)92-54(23-15-28-84-76(79)80)68(108)94-55(67(107)86-38-62(78)102)29-44-16-9-7-10-17-44/h7-14,16-20,22,24-27,36-37,41-42,49,53-61,65,85,101H,5-6,15,21,23,28-35,38-40H2,1-4H3,(H2,78,102)(H,83,88)(H,86,107)(H,87,106)(H,89,100)(H,91,103)(H,92,111)(H,93,114)(H,94,108)(H,95,109)(H,96,113)(H,97,110)(H,98,112)(H,104,105)(H4,79,80,84)(H4,81,82,90)/t49-,53-,54-,55-,56-,57-,58-,59-,60+,61-,65-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268804
(Ac-Tyr-Val-Nle-Gly-His-DPhe-Pro-Trp-Asp-Arg-Phe-Gl...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r,wU:8.8,45.46,59.63,96.101,35.35,77.82,wD:4.4,12.21,63.66,85.90,(2.68,-6.73,;1.36,-7.52,;.01,-6.75,;-1.31,-7.53,;-2.65,-6.78,;-3.99,-7.57,;-3.97,-9.11,;-2.62,-9.86,;-5.3,-9.89,;-5.28,-11.43,;-6.61,-12.22,;-7.94,-11.46,;-6.59,-13.75,;-5.25,-14.51,;-3.92,-13.72,;-3.94,-12.19,;-2.61,-11.4,;-1.26,-12.16,;.06,-11.37,;-1.25,-13.71,;-2.58,-14.49,;-7.92,-14.54,;-7.92,-16.08,;-9.23,-16.86,;-6.56,-16.83,;-6.64,-9.14,;-6.65,-7.59,;-7.95,-9.92,;-2.67,-5.24,;-4.01,-4.49,;-1.35,-4.46,;-1.37,-2.92,;-.03,-2.13,;1.32,-2.89,;-.05,-.59,;1.27,.2,;1.26,1.73,;-.08,2.49,;-.25,4.02,;-1.77,4.33,;-2.52,2.99,;-1.48,1.85,;2.62,-.57,;2.64,-2.11,;3.94,.22,;5.29,-.54,;5.31,-2.09,;6.64,-2.84,;6.66,-4.39,;8,-5.15,;9.32,-4.36,;9.3,-2.82,;7.96,-2.06,;6.65,.17,;7.9,-.73,;6.72,1.71,;5.7,2.87,;6.48,4.19,;7.98,3.86,;8.13,2.32,;9.45,1.54,;9.44,-0,;10.8,2.29,;12.11,1.49,;12.1,-.05,;13.38,-.9,;14.82,-.37,;15.78,-1.58,;14.93,-2.86,;15.31,-4.35,;14.21,-5.43,;12.73,-5.02,;12.34,-3.52,;13.44,-2.45,;13.46,2.25,;13.47,3.79,;14.78,1.46,;16.13,2.22,;16.14,3.76,;17.48,4.52,;18.82,3.75,;17.5,6.06,;17.45,1.44,;17.43,-.1,;18.79,2.2,;20.11,1.4,;20.09,-.14,;21.42,-.92,;21.41,-2.46,;22.74,-3.24,;22.71,-4.78,;21.38,-5.53,;24.05,-5.55,;21.45,2.16,;21.46,3.7,;22.79,1.39,;24.13,2.15,;24.14,3.68,;25.48,4.44,;26.81,3.66,;28.16,4.41,;28.17,5.95,;26.84,6.74,;25.51,5.98,;25.46,1.36,;25.44,-.18,;26.8,2.12,;28.12,1.33,;29.46,2.09,;30.79,1.3,;29.47,3.63,)| Show InChI InChI=1S/C76H99N19O16/c1-5-6-22-53(89-74(110)65(43(2)3)94-72(108)56(86-44(4)96)33-47-26-28-50(97)29-27-47)66(102)84-41-63(99)87-58(36-49-39-80-42-85-49)70(106)93-60(34-46-19-11-8-12-20-46)75(111)95-31-16-25-61(95)73(109)92-57(35-48-38-82-52-23-14-13-21-51(48)52)69(105)91-59(37-64(100)101)71(107)88-54(24-15-30-81-76(78)79)68(104)90-55(67(103)83-40-62(77)98)32-45-17-9-7-10-18-45/h7-14,17-21,23,26-29,38-39,42-43,53-61,65,82,97H,5-6,15-16,22,24-25,30-37,40-41H2,1-4H3,(H2,77,98)(H,80,85)(H,83,103)(H,84,102)(H,86,96)(H,87,99)(H,88,107)(H,89,110)(H,90,104)(H,91,105)(H,92,109)(H,93,106)(H,94,108)(H,100,101)(H4,78,79,81)/t53-,54-,55-,56-,57-,58-,59-,60+,61-,65-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268802
(Ac-Nle-c[Asp-cis-4-guanidinyl-Pro-DNal(2')-Arg-Trp...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2C[C@@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,12.11,21.81,50.52,wD:25.25,39.41,65.73,67.77,(39.57,-47.74,;38.21,-47.02,;38.16,-45.48,;36.8,-44.75,;36.75,-43.21,;38.06,-42.4,;38,-40.86,;39.31,-40.04,;36.65,-40.13,;35.39,-42.49,;35.34,-40.95,;34.08,-43.3,;32.72,-42.58,;31.42,-43.39,;31.47,-44.93,;32.83,-45.65,;30.16,-45.74,;28.8,-45.02,;27.49,-45.83,;26.13,-45.1,;24.82,-45.91,;23.47,-45.19,;23.42,-43.65,;22.06,-42.92,;20.75,-43.74,;22.01,-41.38,;20.63,-40.65,;19.18,-41.16,;17.92,-40.26,;16.69,-41.18,;17.19,-42.65,;16.46,-44,;17.25,-45.3,;18.8,-45.26,;19.52,-43.91,;18.73,-42.62,;23.31,-40.57,;24.63,-40.8,;25.96,-41.59,;23.26,-39.03,;21.9,-38.31,;21.85,-36.77,;20.5,-36.04,;20.44,-34.5,;19.08,-33.78,;19.04,-32.24,;17.77,-34.59,;24.57,-38.22,;25.93,-38.94,;25.98,-40.48,;27.24,-38.13,;27.19,-36.59,;25.83,-35.86,;24.52,-36.68,;23.17,-35.96,;23.11,-34.42,;21.76,-33.69,;21.71,-32.15,;23.02,-31.33,;24.38,-32.07,;24.43,-33.61,;25.78,-34.33,;28.59,-38.85,;29.91,-38.05,;29.86,-36.5,;31.27,-38.78,;32.35,-37.67,;33.85,-38.07,;33.84,-39.61,;31.31,-40.3,;32.67,-41.04,;33.98,-40.22,;35.07,-37.14,;34.87,-35.61,;33.45,-35.01,;36.1,-34.67,;22.16,-46,;20.8,-45.28,;22.21,-47.54,)| Show InChI InChI=1S/C54H74N16O9/c1-3-4-15-39(63-30(2)71)47(74)69-43-27-45(72)60-21-10-9-17-38(46(55)73)65-50(77)42(25-34-28-62-37-16-8-7-14-36(34)37)67-48(75)40(18-11-22-61-53(56)57)66-49(76)41(24-31-19-20-32-12-5-6-13-33(32)23-31)68-51(78)44-26-35(64-54(58)59)29-70(44)52(43)79/h5-8,12-14,16,19-20,23,28,35,38-44,62H,3-4,9-11,15,17-18,21-22,24-27,29H2,1-2H3,(H2,55,73)(H,60,72)(H,63,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,56,57,61)(H4,58,59,64)/t35-,38-,39-,40-,41+,42-,43-,44-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | n/a | n/a | 1.70E+3 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50184359
((3S,6S,9R,12S,15S,23S)-15-((S)-2-acetylamino-hexan...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r,wU:21.75,50.52,12.11,4.4,39.41,wD:25.25,61.64,(19.68,-11.7,;18.32,-10.97,;18.27,-9.43,;16.91,-8.71,;16.86,-7.17,;18.17,-6.36,;18.11,-4.82,;19.42,-4,;16.76,-4.09,;15.5,-6.44,;15.45,-4.9,;14.19,-7.26,;12.83,-6.53,;11.53,-7.35,;11.58,-8.88,;12.94,-9.61,;10.27,-9.7,;8.91,-8.97,;7.6,-9.79,;6.25,-9.06,;4.94,-9.87,;3.58,-9.15,;3.53,-7.61,;2.17,-6.88,;.86,-7.7,;2.12,-5.35,;.76,-4.62,;.71,-3.08,;1.93,-2.14,;1.41,-.69,;-.14,-.74,;-1.21,.35,;-2.69,-.02,;-3.1,-1.51,;-2.03,-2.6,;-.56,-2.22,;3.43,-4.53,;4.79,-5.26,;4.84,-6.8,;6.98,-5.22,;8.76,-4.36,;10.12,-5.08,;10.17,-6.62,;8.86,-7.43,;7.5,-6.71,;6.19,-7.52,;8.83,-5.93,;6.09,-4.44,;6.04,-2.9,;4.68,-2.18,;7.35,-2.09,;7.3,-.55,;5.94,.17,;5.89,1.71,;4.53,2.44,;3.23,1.62,;3.28,.07,;4.64,-.64,;8.71,-2.82,;10.02,-2,;9.96,-.46,;11.37,-2.73,;12.68,-1.91,;12.64,-.37,;13.86,.56,;13.35,2.01,;11.81,1.97,;11.37,.5,;11.42,-4.27,;12.78,-4.99,;14.09,-4.18,;2.27,-9.96,;.91,-9.24,;2.32,-11.5,)| Show InChI InChI=1S/C50H69N15O9/c1-3-4-16-36(59-29(2)66)44(69)65-41-25-42(67)55-20-11-10-18-35(43(51)68)60-47(72)39(23-31-26-57-34-17-9-8-15-33(31)34)63-45(70)37(19-12-21-56-50(52)53)61-46(71)38(22-30-13-6-5-7-14-30)62-48(73)40(64-49(41)74)24-32-27-54-28-58-32/h5-9,13-15,17,26-28,35-41,57H,3-4,10-12,16,18-25H2,1-2H3,(H2,51,68)(H,54,58)(H,55,67)(H,59,66)(H,60,72)(H,61,71)(H,62,73)(H,63,70)(H,64,74)(H,65,69)(H4,52,53,56)/t35-,36-,37-,38+,39-,40-,41-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
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| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 0.300 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268801
(Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DNal(2')-Arg-T...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,12.11,67.77,21.81,50.52,wD:25.25,39.41,65.73,(14,-47.54,;12.64,-46.82,;12.59,-45.28,;11.23,-44.55,;11.18,-43.02,;12.48,-42.2,;12.43,-40.66,;13.74,-39.85,;11.08,-39.94,;9.82,-42.29,;9.77,-40.75,;8.51,-43.1,;7.15,-42.38,;5.85,-43.19,;5.9,-44.73,;7.25,-45.46,;4.58,-45.55,;3.23,-44.82,;1.92,-45.64,;.56,-44.9,;-.75,-45.72,;-2.1,-44.99,;-2.16,-43.45,;-3.51,-42.73,;-4.83,-43.54,;-3.56,-41.19,;-4.94,-40.46,;-6.39,-40.96,;-7.65,-40.07,;-8.88,-40.99,;-8.38,-42.46,;-9.11,-43.8,;-8.32,-45.1,;-6.78,-45.06,;-6.05,-43.72,;-6.84,-42.42,;-2.26,-40.37,;-.94,-40.6,;.38,-41.4,;-2.31,-38.83,;-3.67,-38.11,;-3.72,-36.57,;-5.08,-35.85,;-5.13,-34.31,;-6.49,-33.58,;-6.54,-32.04,;-7.8,-34.4,;-1,-38.02,;.36,-38.75,;.41,-40.29,;1.67,-37.93,;1.61,-36.39,;.26,-35.67,;-1.06,-36.48,;-2.41,-35.77,;-2.46,-34.22,;-3.82,-33.49,;-3.87,-31.96,;-2.55,-31.14,;-1.19,-31.87,;-1.15,-33.41,;.21,-34.13,;3.02,-38.66,;4.34,-37.85,;4.28,-36.3,;5.7,-38.58,;6.78,-37.48,;8.27,-37.87,;8.27,-39.41,;5.74,-40.1,;7.1,-40.84,;8.41,-40.03,;9.5,-36.94,;9.3,-35.41,;7.88,-34.82,;10.52,-34.48,;-3.41,-45.81,;-4.77,-45.08,;-3.37,-47.35,)| Show InChI InChI=1S/C54H74N16O9/c1-3-4-15-39(63-30(2)71)47(74)69-43-27-45(72)60-21-10-9-17-38(46(55)73)65-50(77)42(25-34-28-62-37-16-8-7-14-36(34)37)67-48(75)40(18-11-22-61-53(56)57)66-49(76)41(24-31-19-20-32-12-5-6-13-33(32)23-31)68-51(78)44-26-35(64-54(58)59)29-70(44)52(43)79/h5-8,12-14,16,19-20,23,28,35,38-44,62H,3-4,9-11,15,17-18,21-22,24-27,29H2,1-2H3,(H2,55,73)(H,60,72)(H,63,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,56,57,61)(H4,58,59,64)/t35-,38+,39+,40+,41-,42+,43+,44+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 620 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268795
(Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DPhe-Arg-Trp-L...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,63.72,12.11,21.76,wD:25.25,39.41,61.68,(21.05,-10.24,;19.69,-9.52,;19.64,-7.97,;18.28,-7.25,;18.23,-5.71,;19.54,-4.89,;19.48,-3.35,;20.79,-2.54,;18.13,-2.63,;16.87,-4.98,;16.82,-3.44,;15.56,-5.8,;14.2,-5.07,;12.89,-5.89,;12.94,-7.43,;14.3,-8.15,;11.63,-8.24,;10.27,-7.52,;8.96,-8.33,;7.6,-7.6,;6.29,-8.41,;4.93,-7.69,;4.88,-6.15,;3.52,-5.42,;2.21,-6.24,;3.47,-3.88,;2.1,-3.15,;.64,-3.65,;-.62,-2.76,;-1.85,-3.68,;-1.35,-5.15,;-2.08,-6.49,;-1.28,-7.8,;.26,-7.76,;.99,-6.41,;.19,-5.12,;4.78,-3.07,;6.1,-3.3,;7.43,-4.09,;4.73,-1.52,;3.37,-.8,;3.32,.74,;1.96,1.47,;1.91,3.01,;.54,3.73,;.5,5.28,;-.76,2.92,;6.03,-.71,;7.4,-1.43,;7.45,-2.98,;8.71,-.62,;8.66,.92,;7.3,1.65,;7.25,3.18,;5.89,3.91,;4.58,3.1,;4.63,1.55,;5.98,.83,;10.06,-1.35,;11.38,-.54,;11.33,1.01,;12.75,-1.27,;13.83,-.17,;15.32,-.56,;15.32,-2.1,;12.78,-2.79,;14.15,-3.53,;15.45,-2.72,;16.54,.37,;16.34,1.9,;14.92,2.5,;17.57,2.84,;3.63,-8.5,;2.26,-7.78,;3.67,-10.04,)| Show InChI InChI=1S/C50H72N16O9/c1-3-4-16-35(59-28(2)67)43(70)65-39-25-41(68)56-20-11-10-18-34(42(51)69)61-46(73)38(23-30-26-58-33-17-9-8-15-32(30)33)63-44(71)36(19-12-21-57-49(52)53)62-45(72)37(22-29-13-6-5-7-14-29)64-47(74)40-24-31(60-50(54)55)27-66(40)48(39)75/h5-9,13-15,17,26,31,34-40,58H,3-4,10-12,16,18-25,27H2,1-2H3,(H2,51,69)(H,56,68)(H,59,67)(H,61,73)(H,62,72)(H,63,71)(H,64,74)(H,65,70)(H4,52,53,57)(H4,54,55,60)/t31-,34+,35+,36+,37-,38+,39+,40+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 820 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268795
(Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DPhe-Arg-Trp-L...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,63.72,12.11,21.76,wD:25.25,39.41,61.68,(21.05,-10.24,;19.69,-9.52,;19.64,-7.97,;18.28,-7.25,;18.23,-5.71,;19.54,-4.89,;19.48,-3.35,;20.79,-2.54,;18.13,-2.63,;16.87,-4.98,;16.82,-3.44,;15.56,-5.8,;14.2,-5.07,;12.89,-5.89,;12.94,-7.43,;14.3,-8.15,;11.63,-8.24,;10.27,-7.52,;8.96,-8.33,;7.6,-7.6,;6.29,-8.41,;4.93,-7.69,;4.88,-6.15,;3.52,-5.42,;2.21,-6.24,;3.47,-3.88,;2.1,-3.15,;.64,-3.65,;-.62,-2.76,;-1.85,-3.68,;-1.35,-5.15,;-2.08,-6.49,;-1.28,-7.8,;.26,-7.76,;.99,-6.41,;.19,-5.12,;4.78,-3.07,;6.1,-3.3,;7.43,-4.09,;4.73,-1.52,;3.37,-.8,;3.32,.74,;1.96,1.47,;1.91,3.01,;.54,3.73,;.5,5.28,;-.76,2.92,;6.03,-.71,;7.4,-1.43,;7.45,-2.98,;8.71,-.62,;8.66,.92,;7.3,1.65,;7.25,3.18,;5.89,3.91,;4.58,3.1,;4.63,1.55,;5.98,.83,;10.06,-1.35,;11.38,-.54,;11.33,1.01,;12.75,-1.27,;13.83,-.17,;15.32,-.56,;15.32,-2.1,;12.78,-2.79,;14.15,-3.53,;15.45,-2.72,;16.54,.37,;16.34,1.9,;14.92,2.5,;17.57,2.84,;3.63,-8.5,;2.26,-7.78,;3.67,-10.04,)| Show InChI InChI=1S/C50H72N16O9/c1-3-4-16-35(59-28(2)67)43(70)65-39-25-41(68)56-20-11-10-18-34(42(51)69)61-46(73)38(23-30-26-58-33-17-9-8-15-32(30)33)63-44(71)36(19-12-21-57-49(52)53)62-45(72)37(22-29-13-6-5-7-14-29)64-47(74)40-24-31(60-50(54)55)27-66(40)48(39)75/h5-9,13-15,17,26,31,34-40,58H,3-4,10-12,16,18-25,27H2,1-2H3,(H2,51,69)(H,56,68)(H,59,67)(H,61,73)(H,62,72)(H,63,71)(H,64,74)(H,65,70)(H4,52,53,57)(H4,54,55,60)/t31-,34+,35+,36+,37-,38+,39+,40+/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.60 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50184359
((3S,6S,9R,12S,15S,23S)-15-((S)-2-acetylamino-hexan...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r,wU:21.75,50.52,12.11,4.4,39.41,wD:25.25,61.64,(19.68,-11.7,;18.32,-10.97,;18.27,-9.43,;16.91,-8.71,;16.86,-7.17,;18.17,-6.36,;18.11,-4.82,;19.42,-4,;16.76,-4.09,;15.5,-6.44,;15.45,-4.9,;14.19,-7.26,;12.83,-6.53,;11.53,-7.35,;11.58,-8.88,;12.94,-9.61,;10.27,-9.7,;8.91,-8.97,;7.6,-9.79,;6.25,-9.06,;4.94,-9.87,;3.58,-9.15,;3.53,-7.61,;2.17,-6.88,;.86,-7.7,;2.12,-5.35,;.76,-4.62,;.71,-3.08,;1.93,-2.14,;1.41,-.69,;-.14,-.74,;-1.21,.35,;-2.69,-.02,;-3.1,-1.51,;-2.03,-2.6,;-.56,-2.22,;3.43,-4.53,;4.79,-5.26,;4.84,-6.8,;6.98,-5.22,;8.76,-4.36,;10.12,-5.08,;10.17,-6.62,;8.86,-7.43,;7.5,-6.71,;6.19,-7.52,;8.83,-5.93,;6.09,-4.44,;6.04,-2.9,;4.68,-2.18,;7.35,-2.09,;7.3,-.55,;5.94,.17,;5.89,1.71,;4.53,2.44,;3.23,1.62,;3.28,.07,;4.64,-.64,;8.71,-2.82,;10.02,-2,;9.96,-.46,;11.37,-2.73,;12.68,-1.91,;12.64,-.37,;13.86,.56,;13.35,2.01,;11.81,1.97,;11.37,.5,;11.42,-4.27,;12.78,-4.99,;14.09,-4.18,;2.27,-9.96,;.91,-9.24,;2.32,-11.5,)| Show InChI InChI=1S/C50H69N15O9/c1-3-4-16-36(59-29(2)66)44(69)65-41-25-42(67)55-20-11-10-18-35(43(51)68)60-47(72)39(23-31-26-57-34-17-9-8-15-33(31)34)63-45(70)37(19-12-21-56-50(52)53)61-46(71)38(22-30-13-6-5-7-14-30)62-48(73)40(64-49(41)74)24-32-27-54-28-58-32/h5-9,13-15,17,26-28,35-41,57H,3-4,10-12,16,18-25H2,1-2H3,(H2,51,68)(H,54,58)(H,55,67)(H,59,66)(H,60,72)(H,61,71)(H,62,73)(H,63,70)(H,64,74)(H,65,69)(H4,52,53,56)/t35-,36-,37-,38+,39-,40-,41-/m0/s1 | PDB
KEGG
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| Article
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| n/a | n/a | n/a | n/a | 2.90 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC4R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50121268
(21-(2-Acetylamino-hexanoylamino)-7-[3-(diaminometh...)Show SMILES CCCC[C@@H](NC(C)=O)C(=O)N[C@@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O Show InChI InChI=1S/C54H71N15O9/c1-3-4-15-40(63-31(2)70)48(73)69-45-27-46(71)59-21-10-9-17-39(47(55)72)64-51(76)43(25-35-28-61-38-16-8-7-14-37(35)38)67-49(74)41(18-11-22-60-54(56)57)65-50(75)42(24-32-19-20-33-12-5-6-13-34(33)23-32)66-52(77)44(68-53(45)78)26-36-29-58-30-62-36/h5-8,12-14,16,19-20,23,28-30,39-45,61H,3-4,9-11,15,17-18,21-22,24-27H2,1-2H3,(H2,55,72)(H,58,62)(H,59,71)(H,63,70)(H,64,76)(H,65,75)(H,66,77)(H,67,74)(H,68,78)(H,69,73)(H4,56,57,60)/t39-,40+,41-,42+,43-,44-,45+/m0/s1 | PDB
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antibodypedia
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| n/a | n/a | n/a | n/a | 1.20 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268804
(Ac-Tyr-Val-Nle-Gly-His-DPhe-Pro-Trp-Asp-Arg-Phe-Gl...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r,wU:8.8,45.46,59.63,96.101,35.35,77.82,wD:4.4,12.21,63.66,85.90,(2.68,-6.73,;1.36,-7.52,;.01,-6.75,;-1.31,-7.53,;-2.65,-6.78,;-3.99,-7.57,;-3.97,-9.11,;-2.62,-9.86,;-5.3,-9.89,;-5.28,-11.43,;-6.61,-12.22,;-7.94,-11.46,;-6.59,-13.75,;-5.25,-14.51,;-3.92,-13.72,;-3.94,-12.19,;-2.61,-11.4,;-1.26,-12.16,;.06,-11.37,;-1.25,-13.71,;-2.58,-14.49,;-7.92,-14.54,;-7.92,-16.08,;-9.23,-16.86,;-6.56,-16.83,;-6.64,-9.14,;-6.65,-7.59,;-7.95,-9.92,;-2.67,-5.24,;-4.01,-4.49,;-1.35,-4.46,;-1.37,-2.92,;-.03,-2.13,;1.32,-2.89,;-.05,-.59,;1.27,.2,;1.26,1.73,;-.08,2.49,;-.25,4.02,;-1.77,4.33,;-2.52,2.99,;-1.48,1.85,;2.62,-.57,;2.64,-2.11,;3.94,.22,;5.29,-.54,;5.31,-2.09,;6.64,-2.84,;6.66,-4.39,;8,-5.15,;9.32,-4.36,;9.3,-2.82,;7.96,-2.06,;6.65,.17,;7.9,-.73,;6.72,1.71,;5.7,2.87,;6.48,4.19,;7.98,3.86,;8.13,2.32,;9.45,1.54,;9.44,-0,;10.8,2.29,;12.11,1.49,;12.1,-.05,;13.38,-.9,;14.82,-.37,;15.78,-1.58,;14.93,-2.86,;15.31,-4.35,;14.21,-5.43,;12.73,-5.02,;12.34,-3.52,;13.44,-2.45,;13.46,2.25,;13.47,3.79,;14.78,1.46,;16.13,2.22,;16.14,3.76,;17.48,4.52,;18.82,3.75,;17.5,6.06,;17.45,1.44,;17.43,-.1,;18.79,2.2,;20.11,1.4,;20.09,-.14,;21.42,-.92,;21.41,-2.46,;22.74,-3.24,;22.71,-4.78,;21.38,-5.53,;24.05,-5.55,;21.45,2.16,;21.46,3.7,;22.79,1.39,;24.13,2.15,;24.14,3.68,;25.48,4.44,;26.81,3.66,;28.16,4.41,;28.17,5.95,;26.84,6.74,;25.51,5.98,;25.46,1.36,;25.44,-.18,;26.8,2.12,;28.12,1.33,;29.46,2.09,;30.79,1.3,;29.47,3.63,)| Show InChI InChI=1S/C76H99N19O16/c1-5-6-22-53(89-74(110)65(43(2)3)94-72(108)56(86-44(4)96)33-47-26-28-50(97)29-27-47)66(102)84-41-63(99)87-58(36-49-39-80-42-85-49)70(106)93-60(34-46-19-11-8-12-20-46)75(111)95-31-16-25-61(95)73(109)92-57(35-48-38-82-52-23-14-13-21-51(48)52)69(105)91-59(37-64(100)101)71(107)88-54(24-15-30-81-76(78)79)68(104)90-55(67(103)83-40-62(77)98)32-45-17-9-7-10-18-45/h7-14,17-21,23,26-29,38-39,42-43,53-61,65,82,97H,5-6,15-16,22,24-25,30-37,40-41H2,1-4H3,(H2,77,98)(H,80,85)(H,83,103)(H,84,102)(H,86,96)(H,87,99)(H,88,107)(H,89,110)(H,90,104)(H,91,105)(H,92,109)(H,93,106)(H,94,108)(H,100,101)(H4,78,79,81)/t53-,54-,55-,56-,57-,58-,59-,60+,61-,65-/m0/s1 | PDB
UniProtKB/SwissProt
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PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC3R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50121268
(21-(2-Acetylamino-hexanoylamino)-7-[3-(diaminometh...)Show SMILES CCCC[C@@H](NC(C)=O)C(=O)N[C@@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O Show InChI InChI=1S/C54H71N15O9/c1-3-4-15-40(63-31(2)70)48(73)69-45-27-46(71)59-21-10-9-17-39(47(55)72)64-51(76)43(25-35-28-61-38-16-8-7-14-37(35)38)67-49(74)41(18-11-22-60-54(56)57)65-50(75)42(24-32-19-20-33-12-5-6-13-34(33)23-32)66-52(77)44(68-53(45)78)26-36-29-58-30-62-36/h5-8,12-14,16,19-20,23,28-30,39-45,61H,3-4,9-11,15,17-18,21-22,24-27H2,1-2H3,(H2,55,72)(H,58,62)(H,59,71)(H,63,70)(H,64,76)(H,65,75)(H,66,77)(H,67,74)(H,68,78)(H,69,73)(H4,56,57,60)/t39-,40+,41-,42+,43-,44-,45+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
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| CHEMBL
PC cid
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PubMed
| n/a | n/a | n/a | n/a | 1.5 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268800
(Ac-Nle-c[Asp-His-DNal(2')-cis-4-guanidinyl-Pro-Trp...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.81,12.11,4.4,39.45,wD:61.66,25.25,41.77,(17.08,-28.2,;15.72,-27.49,;15.65,-25.95,;14.29,-25.23,;14.22,-23.7,;15.52,-22.87,;15.46,-21.33,;16.76,-20.51,;14.09,-20.62,;12.85,-22.98,;12.79,-21.44,;11.56,-23.81,;10.19,-23.09,;8.89,-23.93,;8.95,-25.47,;10.32,-26.17,;7.66,-26.29,;6.29,-25.58,;4.99,-26.4,;3.62,-25.69,;2.33,-26.52,;.96,-25.8,;.9,-24.26,;-.47,-23.55,;-1.77,-24.38,;-.53,-22.01,;-1.9,-21.3,;-1.97,-19.76,;-.75,-18.81,;-1.29,-17.36,;-2.83,-17.43,;-3.91,-16.34,;-5.39,-16.73,;-5.79,-18.22,;-4.71,-19.3,;-3.24,-18.91,;.77,-21.19,;1.43,-22.26,;1.77,-23.81,;2.13,-21.9,;2.76,-23.47,;4.3,-23.41,;4.72,-21.93,;3.43,-21.07,;3.37,-19.54,;2,-18.82,;4.67,-18.71,;4.6,-17.17,;3.24,-16.46,;1.94,-17.29,;.57,-16.58,;.5,-15.04,;-.85,-14.32,;-.92,-12.79,;.39,-11.96,;1.75,-12.68,;1.81,-14.22,;3.17,-14.92,;6.03,-19.42,;7.33,-18.6,;7.26,-17.05,;8.7,-19.3,;10,-18.48,;9.94,-16.94,;11.15,-15.99,;10.63,-14.55,;9.09,-14.6,;8.66,-16.08,;8.76,-20.84,;10.13,-21.56,;11.43,-20.73,;5.25,-24.61,;6.76,-24.38,;7.52,-24.99,;7.32,-22.97,;-.34,-26.63,;-1.71,-25.91,;-.27,-28.17,)| Show InChI InChI=1S/C54H69N15O9/c1-3-4-14-40(62-30(2)70)48(73)66-43-25-46(71)59-19-10-9-16-39(47(55)72)64-49(74)41(22-34-26-60-38-15-8-7-13-37(34)38)67-52(77)45-24-36(63-54(56)57)28-69(45)53(78)44(21-31-17-18-32-11-5-6-12-33(32)20-31)68-50(75)42(65-51(43)76)23-35-27-58-29-61-35/h5-8,11-13,15,17-18,20,26-27,29,36,39-45,60H,3-4,9-10,14,16,19,21-25,28H2,1-2H3,(H2,55,72)(H,58,61)(H,59,71)(H,62,70)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,75)(H4,56,57,63)/t36-,39+,40+,41+,42+,43+,44-,45+/m1/s1 | PDB
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | n/a | n/a | 1.90E+4 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268798
(Ac-Nle-c[Asp-His-DNaI(2')-Pro-Trp-Lys]-NH2 | CHEMB...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r| Show InChI InChI=1S/C53H66N12O9/c1-3-4-15-40(59-31(2)66)48(69)62-43-27-46(67)56-21-10-9-17-39(47(54)68)60-49(70)41(25-35-28-57-38-16-8-7-14-37(35)38)63-52(73)45-18-11-22-65(45)53(74)44(24-32-19-20-33-12-5-6-13-34(33)23-32)64-50(71)42(61-51(43)72)26-36-29-55-30-58-36/h5-8,12-14,16,19-20,23,28-30,39-45,57H,3-4,9-11,15,17-18,21-22,24-27H2,1-2H3,(H2,54,68)(H,55,58)(H,56,67)(H,59,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)/t39-,40-,41-,42-,43-,44+,45-/m0/s1 | PDB
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antibodypedia
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PC cid
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PubMed
| n/a | n/a | n/a | n/a | 160 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268806
(Ac-Tyr-Val-Nle-Gly-His-DPhe-Arg-Trp-Asp-Arg-Phe-Gl...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r,wU:12.21,56.58,35.35,81.85,45.46,4.4,100.104,wD:67.69,8.8,89.93,(6.82,-32.01,;5.49,-32.78,;5.49,-34.31,;4.16,-35.09,;4.16,-36.62,;2.82,-37.38,;1.49,-36.61,;1.49,-35.08,;.16,-37.38,;-1.17,-36.62,;-2.5,-37.4,;-2.5,-38.94,;-3.83,-36.63,;-3.83,-35.09,;-2.49,-34.32,;-1.16,-35.09,;.18,-34.32,;.18,-32.78,;1.51,-32,;-1.15,-32.01,;-2.49,-32.78,;-5.18,-37.37,;-6.51,-36.6,;-7.85,-37.37,;-6.51,-35.06,;.16,-38.93,;1.49,-39.69,;-1.18,-39.7,;5.49,-37.39,;5.49,-38.94,;6.83,-36.63,;8.16,-37.4,;9.49,-36.63,;9.49,-35.09,;10.83,-37.4,;12.17,-36.64,;12.17,-35.1,;13.5,-34.33,;14.91,-34.96,;15.95,-33.81,;15.17,-32.48,;13.66,-32.79,;13.5,-37.41,;13.5,-38.95,;14.83,-36.63,;16.17,-37.4,;16.17,-38.95,;17.5,-39.71,;18.84,-38.95,;20.17,-39.72,;20.17,-41.26,;18.83,-42.03,;17.5,-41.26,;17.5,-36.63,;17.5,-35.1,;18.83,-37.4,;20.18,-36.65,;20.18,-35.11,;21.51,-34.34,;21.51,-32.81,;22.84,-32.03,;22.85,-30.49,;21.51,-29.71,;24.18,-29.72,;21.51,-37.42,;21.51,-38.97,;22.84,-36.64,;24.17,-37.41,;24.17,-38.95,;25.5,-39.72,;26.91,-39.1,;27.94,-40.24,;27.17,-41.58,;27.64,-43.04,;26.61,-44.18,;25.1,-43.86,;24.63,-42.39,;25.66,-41.25,;25.5,-36.64,;25.5,-35.1,;26.84,-37.41,;28.17,-36.64,;28.17,-35.11,;29.5,-34.34,;30.83,-35.11,;29.5,-32.8,;29.5,-37.42,;29.5,-38.96,;30.84,-36.64,;32.17,-37.41,;32.17,-38.96,;33.49,-39.72,;33.49,-41.27,;34.82,-42.04,;34.83,-43.58,;33.49,-44.35,;36.16,-44.35,;33.49,-36.64,;33.49,-35.11,;34.83,-37.41,;36.16,-36.64,;36.16,-35.1,;37.5,-34.34,;38.83,-35.11,;40.16,-34.34,;40.17,-32.8,;38.84,-32.03,;37.5,-32.79,;37.5,-37.42,;37.5,-38.95,;38.83,-36.64,;40.16,-37.41,;41.48,-36.64,;42.83,-37.42,;41.48,-35.11,)| Show InChI InChI=1S/C77H104N22O16/c1-5-6-22-53(94-75(115)65(43(2)3)99-74(114)57(90-44(4)100)34-47-26-28-50(101)29-27-47)66(106)88-41-63(103)91-60(36-49-39-83-42-89-49)72(112)96-58(33-46-19-11-8-12-20-46)70(110)92-55(25-16-31-85-77(81)82)69(109)97-59(35-48-38-86-52-23-14-13-21-51(48)52)71(111)98-61(37-64(104)105)73(113)93-54(24-15-30-84-76(79)80)68(108)95-56(67(107)87-40-62(78)102)32-45-17-9-7-10-18-45/h7-14,17-21,23,26-29,38-39,42-43,53-61,65,86,101H,5-6,15-16,22,24-25,30-37,40-41H2,1-4H3,(H2,78,102)(H,83,89)(H,87,107)(H,88,106)(H,90,100)(H,91,103)(H,92,110)(H,93,113)(H,94,115)(H,95,108)(H,96,112)(H,97,109)(H,98,111)(H,99,114)(H,104,105)(H4,79,80,84)(H4,81,82,85)/t53-,54-,55-,56-,57-,58+,59-,60-,61-,65-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC3R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268793
(Ac-Nle-c[Asp-His-DPhe-trans-4-guanidinyl-Pro-Trp-L...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.76,12.11,41.72,4.4,39.45,wD:57.61,25.25,(17.82,-24,;16.46,-23.28,;16.41,-21.74,;15.05,-21.01,;15,-19.47,;16.31,-18.66,;16.26,-17.12,;17.56,-16.31,;14.9,-16.39,;13.64,-18.75,;13.59,-17.21,;12.33,-19.56,;10.98,-18.84,;9.67,-19.65,;9.72,-21.19,;11.08,-21.91,;8.41,-22,;7.05,-21.28,;5.75,-22.09,;4.39,-21.37,;3.08,-22.18,;1.72,-21.45,;1.67,-19.91,;.31,-19.19,;-1,-20,;.26,-17.65,;-1.1,-16.92,;-1.15,-15.39,;.08,-14.44,;-.45,-12.99,;-2,-13.05,;-3.06,-11.95,;-4.55,-12.33,;-4.96,-13.81,;-3.88,-14.9,;-2.41,-14.52,;1.57,-16.84,;2.22,-17.92,;2.54,-19.47,;2.93,-17.56,;3.55,-19.14,;5.08,-19.09,;5.51,-17.61,;4.23,-16.75,;4.18,-15.21,;2.82,-14.48,;5.49,-14.4,;5.44,-12.86,;4.08,-12.13,;4.03,-10.59,;2.68,-9.87,;1.37,-10.68,;1.42,-12.23,;2.78,-12.95,;6.85,-15.12,;8.16,-14.31,;8.11,-12.77,;9.51,-15.03,;10.82,-14.22,;10.78,-12.68,;12,-11.74,;11.49,-10.29,;9.95,-10.33,;9.51,-11.81,;9.57,-16.57,;10.92,-17.3,;12.23,-16.48,;6.03,-20.31,;7.52,-19.93,;8.28,-20.74,;8.13,-18.67,;.41,-22.27,;-.95,-21.54,;.46,-23.81,)| Show InChI InChI=1S/C50H67N15O9/c1-3-4-15-36(58-28(2)66)44(69)62-39-23-42(67)55-18-11-10-17-35(43(51)68)60-45(70)37(20-30-24-56-34-16-9-8-14-33(30)34)63-48(73)41-22-32(59-50(52)53)26-65(41)49(74)40(19-29-12-6-5-7-13-29)64-46(71)38(61-47(39)72)21-31-25-54-27-57-31/h5-9,12-14,16,24-25,27,32,35-41,56H,3-4,10-11,15,17-23,26H2,1-2H3,(H2,51,68)(H,54,57)(H,55,67)(H,58,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)(H4,52,53,59)/t32-,35-,36-,37-,38-,39-,40+,41-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.50E+3 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268806
(Ac-Tyr-Val-Nle-Gly-His-DPhe-Arg-Trp-Asp-Arg-Phe-Gl...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r,wU:12.21,56.58,35.35,81.85,45.46,4.4,100.104,wD:67.69,8.8,89.93,(6.82,-32.01,;5.49,-32.78,;5.49,-34.31,;4.16,-35.09,;4.16,-36.62,;2.82,-37.38,;1.49,-36.61,;1.49,-35.08,;.16,-37.38,;-1.17,-36.62,;-2.5,-37.4,;-2.5,-38.94,;-3.83,-36.63,;-3.83,-35.09,;-2.49,-34.32,;-1.16,-35.09,;.18,-34.32,;.18,-32.78,;1.51,-32,;-1.15,-32.01,;-2.49,-32.78,;-5.18,-37.37,;-6.51,-36.6,;-7.85,-37.37,;-6.51,-35.06,;.16,-38.93,;1.49,-39.69,;-1.18,-39.7,;5.49,-37.39,;5.49,-38.94,;6.83,-36.63,;8.16,-37.4,;9.49,-36.63,;9.49,-35.09,;10.83,-37.4,;12.17,-36.64,;12.17,-35.1,;13.5,-34.33,;14.91,-34.96,;15.95,-33.81,;15.17,-32.48,;13.66,-32.79,;13.5,-37.41,;13.5,-38.95,;14.83,-36.63,;16.17,-37.4,;16.17,-38.95,;17.5,-39.71,;18.84,-38.95,;20.17,-39.72,;20.17,-41.26,;18.83,-42.03,;17.5,-41.26,;17.5,-36.63,;17.5,-35.1,;18.83,-37.4,;20.18,-36.65,;20.18,-35.11,;21.51,-34.34,;21.51,-32.81,;22.84,-32.03,;22.85,-30.49,;21.51,-29.71,;24.18,-29.72,;21.51,-37.42,;21.51,-38.97,;22.84,-36.64,;24.17,-37.41,;24.17,-38.95,;25.5,-39.72,;26.91,-39.1,;27.94,-40.24,;27.17,-41.58,;27.64,-43.04,;26.61,-44.18,;25.1,-43.86,;24.63,-42.39,;25.66,-41.25,;25.5,-36.64,;25.5,-35.1,;26.84,-37.41,;28.17,-36.64,;28.17,-35.11,;29.5,-34.34,;30.83,-35.11,;29.5,-32.8,;29.5,-37.42,;29.5,-38.96,;30.84,-36.64,;32.17,-37.41,;32.17,-38.96,;33.49,-39.72,;33.49,-41.27,;34.82,-42.04,;34.83,-43.58,;33.49,-44.35,;36.16,-44.35,;33.49,-36.64,;33.49,-35.11,;34.83,-37.41,;36.16,-36.64,;36.16,-35.1,;37.5,-34.34,;38.83,-35.11,;40.16,-34.34,;40.17,-32.8,;38.84,-32.03,;37.5,-32.79,;37.5,-37.42,;37.5,-38.95,;38.83,-36.64,;40.16,-37.41,;41.48,-36.64,;42.83,-37.42,;41.48,-35.11,)| Show InChI InChI=1S/C77H104N22O16/c1-5-6-22-53(94-75(115)65(43(2)3)99-74(114)57(90-44(4)100)34-47-26-28-50(101)29-27-47)66(106)88-41-63(103)91-60(36-49-39-83-42-89-49)72(112)96-58(33-46-19-11-8-12-20-46)70(110)92-55(25-16-31-85-77(81)82)69(109)97-59(35-48-38-86-52-23-14-13-21-51(48)52)71(111)98-61(37-64(104)105)73(113)93-54(24-15-30-84-76(79)80)68(108)95-56(67(107)87-40-62(78)102)32-45-17-9-7-10-18-45/h7-14,17-21,23,26-29,38-39,42-43,53-61,65,86,101H,5-6,15-16,22,24-25,30-37,40-41H2,1-4H3,(H2,78,102)(H,83,89)(H,87,107)(H,88,106)(H,90,100)(H,91,103)(H,92,110)(H,93,113)(H,94,115)(H,95,108)(H,96,112)(H,97,109)(H,98,111)(H,99,114)(H,104,105)(H4,79,80,84)(H4,81,82,85)/t53-,54-,55-,56-,57-,58+,59-,60-,61-,65-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.40 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC4R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268796
(Ac-Nle-c[Asp-cis-4-guanidinyl-Pro-DPhe-Arg-Trp-Lys...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,12.11,21.76,wD:25.25,39.41,61.68,63.72,(20.34,-25.22,;18.98,-24.49,;18.93,-22.95,;17.57,-22.23,;17.52,-20.69,;18.83,-19.87,;18.78,-18.33,;20.08,-17.51,;17.42,-17.6,;16.16,-19.96,;16.11,-18.42,;14.85,-20.77,;13.49,-20.05,;12.18,-20.86,;12.24,-22.4,;13.59,-23.13,;10.92,-23.22,;9.56,-22.49,;8.26,-23.31,;6.89,-22.58,;5.58,-23.39,;4.23,-22.66,;4.17,-21.12,;2.82,-20.4,;1.5,-21.21,;2.76,-18.86,;1.39,-18.12,;-.07,-18.63,;-1.33,-17.73,;-2.56,-18.65,;-2.05,-20.13,;-2.79,-21.47,;-1.99,-22.78,;-.45,-22.73,;.28,-21.39,;-.52,-20.09,;4.07,-18.04,;5.39,-18.27,;6.72,-19.07,;4.02,-16.5,;2.66,-15.78,;2.61,-14.23,;1.25,-13.51,;1.2,-11.97,;-.17,-11.24,;-.21,-9.7,;-1.47,-12.06,;5.33,-15.69,;6.69,-16.41,;6.74,-17.95,;8,-15.6,;7.95,-14.06,;6.59,-13.33,;6.54,-11.79,;5.18,-11.07,;3.87,-11.88,;3.92,-13.43,;5.27,-14.15,;9.36,-16.32,;10.67,-15.52,;10.62,-13.97,;12.04,-16.25,;13.12,-15.14,;14.62,-15.54,;14.61,-17.08,;12.07,-17.77,;13.44,-18.51,;14.75,-17.69,;15.84,-14.61,;15.64,-13.08,;14.21,-12.48,;16.87,-12.14,;2.92,-23.48,;1.55,-22.75,;2.96,-25.02,)| Show InChI InChI=1S/C50H72N16O9/c1-3-4-16-35(59-28(2)67)43(70)65-39-25-41(68)56-20-11-10-18-34(42(51)69)61-46(73)38(23-30-26-58-33-17-9-8-15-32(30)33)63-44(71)36(19-12-21-57-49(52)53)62-45(72)37(22-29-13-6-5-7-14-29)64-47(74)40-24-31(60-50(54)55)27-66(40)48(39)75/h5-9,13-15,17,26,31,34-40,58H,3-4,10-12,16,18-25,27H2,1-2H3,(H2,51,69)(H,56,68)(H,59,67)(H,61,73)(H,62,72)(H,63,71)(H,64,74)(H,65,70)(H4,52,53,57)(H4,54,55,60)/t31-,34-,35-,36-,37+,38-,39-,40-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 41 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC4R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268799
(Ac-Nle-c[Asp-His-DNal(2')-trans-4-guanidinyl-Pro-T...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.81,12.11,4.4,41.77,39.45,wD:61.66,25.25,(17.63,-10.54,;16.26,-9.83,;16.2,-8.29,;14.83,-7.58,;14.77,-6.04,;16.07,-5.21,;16,-3.68,;17.31,-2.85,;14.64,-2.96,;13.4,-5.33,;13.34,-3.79,;12.11,-6.15,;10.74,-5.44,;9.44,-6.27,;9.5,-7.81,;10.87,-8.52,;8.21,-8.64,;6.84,-7.92,;5.54,-8.75,;4.17,-8.03,;2.88,-8.86,;1.51,-8.15,;1.44,-6.61,;.08,-5.89,;-1.22,-6.72,;.01,-4.36,;-1.35,-3.64,;-1.42,-2.1,;-.2,-1.15,;-.74,.29,;-2.29,.23,;-3.36,1.32,;-4.84,.92,;-5.24,-.57,;-4.16,-1.64,;-2.69,-1.26,;1.32,-3.53,;1.98,-4.61,;2.31,-6.15,;2.67,-4.24,;3.31,-5.82,;4.85,-5.75,;5.26,-4.27,;3.98,-3.42,;3.91,-1.88,;2.55,-1.17,;5.21,-1.05,;5.15,.48,;3.78,1.2,;2.49,.37,;1.12,1.07,;1.05,2.62,;-.31,3.33,;-.37,4.87,;.93,5.7,;2.3,4.98,;2.36,3.44,;3.72,2.73,;6.58,-1.77,;7.88,-.94,;7.81,.6,;9.24,-1.65,;10.54,-.82,;10.49,.72,;11.7,1.66,;11.17,3.11,;9.64,3.06,;9.21,1.58,;9.31,-3.19,;10.67,-3.9,;11.98,-3.07,;5.79,-6.95,;7.3,-6.73,;8.06,-7.33,;7.86,-5.31,;.21,-8.97,;-1.16,-8.26,;.27,-10.51,)| Show InChI InChI=1S/C54H69N15O9/c1-3-4-14-40(62-30(2)70)48(73)66-43-25-46(71)59-19-10-9-16-39(47(55)72)64-49(74)41(22-34-26-60-38-15-8-7-13-37(34)38)67-52(77)45-24-36(63-54(56)57)28-69(45)53(78)44(21-31-17-18-32-11-5-6-12-33(32)20-31)68-50(75)42(65-51(43)76)23-35-27-58-29-61-35/h5-8,11-13,15,17-18,20,26-27,29,36,39-45,60H,3-4,9-10,14,16,19,21-25,28H2,1-2H3,(H2,55,72)(H,58,61)(H,59,71)(H,62,70)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,75)(H4,56,57,63)/t36-,39-,40-,41-,42-,43-,44+,45-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 200 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC4R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268800
(Ac-Nle-c[Asp-His-DNal(2')-cis-4-guanidinyl-Pro-Trp...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.81,12.11,4.4,39.45,wD:61.66,25.25,41.77,(17.08,-28.2,;15.72,-27.49,;15.65,-25.95,;14.29,-25.23,;14.22,-23.7,;15.52,-22.87,;15.46,-21.33,;16.76,-20.51,;14.09,-20.62,;12.85,-22.98,;12.79,-21.44,;11.56,-23.81,;10.19,-23.09,;8.89,-23.93,;8.95,-25.47,;10.32,-26.17,;7.66,-26.29,;6.29,-25.58,;4.99,-26.4,;3.62,-25.69,;2.33,-26.52,;.96,-25.8,;.9,-24.26,;-.47,-23.55,;-1.77,-24.38,;-.53,-22.01,;-1.9,-21.3,;-1.97,-19.76,;-.75,-18.81,;-1.29,-17.36,;-2.83,-17.43,;-3.91,-16.34,;-5.39,-16.73,;-5.79,-18.22,;-4.71,-19.3,;-3.24,-18.91,;.77,-21.19,;1.43,-22.26,;1.77,-23.81,;2.13,-21.9,;2.76,-23.47,;4.3,-23.41,;4.72,-21.93,;3.43,-21.07,;3.37,-19.54,;2,-18.82,;4.67,-18.71,;4.6,-17.17,;3.24,-16.46,;1.94,-17.29,;.57,-16.58,;.5,-15.04,;-.85,-14.32,;-.92,-12.79,;.39,-11.96,;1.75,-12.68,;1.81,-14.22,;3.17,-14.92,;6.03,-19.42,;7.33,-18.6,;7.26,-17.05,;8.7,-19.3,;10,-18.48,;9.94,-16.94,;11.15,-15.99,;10.63,-14.55,;9.09,-14.6,;8.66,-16.08,;8.76,-20.84,;10.13,-21.56,;11.43,-20.73,;5.25,-24.61,;6.76,-24.38,;7.52,-24.99,;7.32,-22.97,;-.34,-26.63,;-1.71,-25.91,;-.27,-28.17,)| Show InChI InChI=1S/C54H69N15O9/c1-3-4-14-40(62-30(2)70)48(73)66-43-25-46(71)59-19-10-9-16-39(47(55)72)64-49(74)41(22-34-26-60-38-15-8-7-13-37(34)38)67-52(77)45-24-36(63-54(56)57)28-69(45)53(78)44(21-31-17-18-32-11-5-6-12-33(32)20-31)68-50(75)42(65-51(43)76)23-35-27-58-29-61-35/h5-8,11-13,15,17-18,20,26-27,29,36,39-45,60H,3-4,9-10,14,16,19,21-25,28H2,1-2H3,(H2,55,72)(H,58,61)(H,59,71)(H,62,70)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,75)(H4,56,57,63)/t36-,39+,40+,41+,42+,43+,44-,45+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 250 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC4R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268798
(Ac-Nle-c[Asp-His-DNaI(2')-Pro-Trp-Lys]-NH2 | CHEMB...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r| Show InChI InChI=1S/C53H66N12O9/c1-3-4-15-40(59-31(2)66)48(69)62-43-27-46(67)56-21-10-9-17-39(47(54)68)60-49(70)41(25-35-28-57-38-16-8-7-14-37(35)38)63-52(73)45-18-11-22-65(45)53(74)44(24-32-19-20-33-12-5-6-13-34(33)23-32)64-50(71)42(61-51(43)72)26-36-29-55-30-58-36/h5-8,12-14,16,19-20,23,28-30,39-45,57H,3-4,9-11,15,17-18,21-22,24-27H2,1-2H3,(H2,54,68)(H,55,58)(H,56,67)(H,59,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)/t39-,40-,41-,42-,43-,44+,45-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 5.70E+3 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC4R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50121268
(21-(2-Acetylamino-hexanoylamino)-7-[3-(diaminometh...)Show SMILES CCCC[C@@H](NC(C)=O)C(=O)N[C@@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O Show InChI InChI=1S/C54H71N15O9/c1-3-4-15-40(63-31(2)70)48(73)69-45-27-46(71)59-21-10-9-17-39(47(55)72)64-51(76)43(25-35-28-61-38-16-8-7-14-37(35)38)67-49(74)41(18-11-22-60-54(56)57)65-50(75)42(24-32-19-20-33-12-5-6-13-34(33)23-32)66-52(77)44(68-53(45)78)26-36-29-58-30-62-36/h5-8,12-14,16,19-20,23,28-30,39-45,61H,3-4,9-11,15,17-18,21-22,24-27H2,1-2H3,(H2,55,72)(H,58,62)(H,59,71)(H,63,70)(H,64,76)(H,65,75)(H,66,77)(H,67,74)(H,68,78)(H,69,73)(H4,56,57,60)/t39-,40+,41-,42+,43-,44-,45+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC3R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268796
(Ac-Nle-c[Asp-cis-4-guanidinyl-Pro-DPhe-Arg-Trp-Lys...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,12.11,21.76,wD:25.25,39.41,61.68,63.72,(20.34,-25.22,;18.98,-24.49,;18.93,-22.95,;17.57,-22.23,;17.52,-20.69,;18.83,-19.87,;18.78,-18.33,;20.08,-17.51,;17.42,-17.6,;16.16,-19.96,;16.11,-18.42,;14.85,-20.77,;13.49,-20.05,;12.18,-20.86,;12.24,-22.4,;13.59,-23.13,;10.92,-23.22,;9.56,-22.49,;8.26,-23.31,;6.89,-22.58,;5.58,-23.39,;4.23,-22.66,;4.17,-21.12,;2.82,-20.4,;1.5,-21.21,;2.76,-18.86,;1.39,-18.12,;-.07,-18.63,;-1.33,-17.73,;-2.56,-18.65,;-2.05,-20.13,;-2.79,-21.47,;-1.99,-22.78,;-.45,-22.73,;.28,-21.39,;-.52,-20.09,;4.07,-18.04,;5.39,-18.27,;6.72,-19.07,;4.02,-16.5,;2.66,-15.78,;2.61,-14.23,;1.25,-13.51,;1.2,-11.97,;-.17,-11.24,;-.21,-9.7,;-1.47,-12.06,;5.33,-15.69,;6.69,-16.41,;6.74,-17.95,;8,-15.6,;7.95,-14.06,;6.59,-13.33,;6.54,-11.79,;5.18,-11.07,;3.87,-11.88,;3.92,-13.43,;5.27,-14.15,;9.36,-16.32,;10.67,-15.52,;10.62,-13.97,;12.04,-16.25,;13.12,-15.14,;14.62,-15.54,;14.61,-17.08,;12.07,-17.77,;13.44,-18.51,;14.75,-17.69,;15.84,-14.61,;15.64,-13.08,;14.21,-12.48,;16.87,-12.14,;2.92,-23.48,;1.55,-22.75,;2.96,-25.02,)| Show InChI InChI=1S/C50H72N16O9/c1-3-4-16-35(59-28(2)67)43(70)65-39-25-41(68)56-20-11-10-18-34(42(51)69)61-46(73)38(23-30-26-58-33-17-9-8-15-32(30)33)63-44(71)36(19-12-21-57-49(52)53)62-45(72)37(22-29-13-6-5-7-14-29)64-47(74)40-24-31(60-50(54)55)27-66(40)48(39)75/h5-9,13-15,17,26,31,34-40,58H,3-4,10-12,16,18-25,27H2,1-2H3,(H2,51,69)(H,56,68)(H,59,67)(H,61,73)(H,62,72)(H,63,71)(H,64,74)(H,65,70)(H4,52,53,57)(H4,54,55,60)/t31-,34-,35-,36-,37+,38-,39-,40-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.50E+3 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC3R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268800
(Ac-Nle-c[Asp-His-DNal(2')-cis-4-guanidinyl-Pro-Trp...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.81,12.11,4.4,39.45,wD:61.66,25.25,41.77,(17.08,-28.2,;15.72,-27.49,;15.65,-25.95,;14.29,-25.23,;14.22,-23.7,;15.52,-22.87,;15.46,-21.33,;16.76,-20.51,;14.09,-20.62,;12.85,-22.98,;12.79,-21.44,;11.56,-23.81,;10.19,-23.09,;8.89,-23.93,;8.95,-25.47,;10.32,-26.17,;7.66,-26.29,;6.29,-25.58,;4.99,-26.4,;3.62,-25.69,;2.33,-26.52,;.96,-25.8,;.9,-24.26,;-.47,-23.55,;-1.77,-24.38,;-.53,-22.01,;-1.9,-21.3,;-1.97,-19.76,;-.75,-18.81,;-1.29,-17.36,;-2.83,-17.43,;-3.91,-16.34,;-5.39,-16.73,;-5.79,-18.22,;-4.71,-19.3,;-3.24,-18.91,;.77,-21.19,;1.43,-22.26,;1.77,-23.81,;2.13,-21.9,;2.76,-23.47,;4.3,-23.41,;4.72,-21.93,;3.43,-21.07,;3.37,-19.54,;2,-18.82,;4.67,-18.71,;4.6,-17.17,;3.24,-16.46,;1.94,-17.29,;.57,-16.58,;.5,-15.04,;-.85,-14.32,;-.92,-12.79,;.39,-11.96,;1.75,-12.68,;1.81,-14.22,;3.17,-14.92,;6.03,-19.42,;7.33,-18.6,;7.26,-17.05,;8.7,-19.3,;10,-18.48,;9.94,-16.94,;11.15,-15.99,;10.63,-14.55,;9.09,-14.6,;8.66,-16.08,;8.76,-20.84,;10.13,-21.56,;11.43,-20.73,;5.25,-24.61,;6.76,-24.38,;7.52,-24.99,;7.32,-22.97,;-.34,-26.63,;-1.71,-25.91,;-.27,-28.17,)| Show InChI InChI=1S/C54H69N15O9/c1-3-4-14-40(62-30(2)70)48(73)66-43-25-46(71)59-19-10-9-16-39(47(55)72)64-49(74)41(22-34-26-60-38-15-8-7-13-37(34)38)67-52(77)45-24-36(63-54(56)57)28-69(45)53(78)44(21-31-17-18-32-11-5-6-12-33(32)20-31)68-50(75)42(65-51(43)76)23-35-27-58-29-61-35/h5-8,11-13,15,17-18,20,26-27,29,36,39-45,60H,3-4,9-10,14,16,19,21-25,28H2,1-2H3,(H2,55,72)(H,58,61)(H,59,71)(H,62,70)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,75)(H4,56,57,63)/t36-,39+,40+,41+,42+,43+,44-,45+/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50184359
((3S,6S,9R,12S,15S,23S)-15-((S)-2-acetylamino-hexan...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r,wU:21.75,50.52,12.11,4.4,39.41,wD:25.25,61.64,(19.68,-11.7,;18.32,-10.97,;18.27,-9.43,;16.91,-8.71,;16.86,-7.17,;18.17,-6.36,;18.11,-4.82,;19.42,-4,;16.76,-4.09,;15.5,-6.44,;15.45,-4.9,;14.19,-7.26,;12.83,-6.53,;11.53,-7.35,;11.58,-8.88,;12.94,-9.61,;10.27,-9.7,;8.91,-8.97,;7.6,-9.79,;6.25,-9.06,;4.94,-9.87,;3.58,-9.15,;3.53,-7.61,;2.17,-6.88,;.86,-7.7,;2.12,-5.35,;.76,-4.62,;.71,-3.08,;1.93,-2.14,;1.41,-.69,;-.14,-.74,;-1.21,.35,;-2.69,-.02,;-3.1,-1.51,;-2.03,-2.6,;-.56,-2.22,;3.43,-4.53,;4.79,-5.26,;4.84,-6.8,;6.98,-5.22,;8.76,-4.36,;10.12,-5.08,;10.17,-6.62,;8.86,-7.43,;7.5,-6.71,;6.19,-7.52,;8.83,-5.93,;6.09,-4.44,;6.04,-2.9,;4.68,-2.18,;7.35,-2.09,;7.3,-.55,;5.94,.17,;5.89,1.71,;4.53,2.44,;3.23,1.62,;3.28,.07,;4.64,-.64,;8.71,-2.82,;10.02,-2,;9.96,-.46,;11.37,-2.73,;12.68,-1.91,;12.64,-.37,;13.86,.56,;13.35,2.01,;11.81,1.97,;11.37,.5,;11.42,-4.27,;12.78,-4.99,;14.09,-4.18,;2.27,-9.96,;.91,-9.24,;2.32,-11.5,)| Show InChI InChI=1S/C50H69N15O9/c1-3-4-16-36(59-29(2)66)44(69)65-41-25-42(67)55-20-11-10-18-35(43(51)68)60-47(72)39(23-31-26-57-34-17-9-8-15-33(31)34)63-45(70)37(19-12-21-56-50(52)53)61-46(71)38(22-30-13-6-5-7-14-30)62-48(73)40(64-49(41)74)24-32-27-54-28-58-32/h5-9,13-15,17,26-28,35-41,57H,3-4,10-12,16,18-25H2,1-2H3,(H2,51,68)(H,54,58)(H,55,67)(H,59,66)(H,60,72)(H,61,71)(H,62,73)(H,63,70)(H,64,74)(H,65,69)(H4,52,53,56)/t35-,36-,37-,38+,39-,40-,41-/m0/s1 | PDB
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| n/a | n/a | n/a | n/a | 1.90 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC3R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268799
(Ac-Nle-c[Asp-His-DNal(2')-trans-4-guanidinyl-Pro-T...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.81,12.11,4.4,41.77,39.45,wD:61.66,25.25,(17.63,-10.54,;16.26,-9.83,;16.2,-8.29,;14.83,-7.58,;14.77,-6.04,;16.07,-5.21,;16,-3.68,;17.31,-2.85,;14.64,-2.96,;13.4,-5.33,;13.34,-3.79,;12.11,-6.15,;10.74,-5.44,;9.44,-6.27,;9.5,-7.81,;10.87,-8.52,;8.21,-8.64,;6.84,-7.92,;5.54,-8.75,;4.17,-8.03,;2.88,-8.86,;1.51,-8.15,;1.44,-6.61,;.08,-5.89,;-1.22,-6.72,;.01,-4.36,;-1.35,-3.64,;-1.42,-2.1,;-.2,-1.15,;-.74,.29,;-2.29,.23,;-3.36,1.32,;-4.84,.92,;-5.24,-.57,;-4.16,-1.64,;-2.69,-1.26,;1.32,-3.53,;1.98,-4.61,;2.31,-6.15,;2.67,-4.24,;3.31,-5.82,;4.85,-5.75,;5.26,-4.27,;3.98,-3.42,;3.91,-1.88,;2.55,-1.17,;5.21,-1.05,;5.15,.48,;3.78,1.2,;2.49,.37,;1.12,1.07,;1.05,2.62,;-.31,3.33,;-.37,4.87,;.93,5.7,;2.3,4.98,;2.36,3.44,;3.72,2.73,;6.58,-1.77,;7.88,-.94,;7.81,.6,;9.24,-1.65,;10.54,-.82,;10.49,.72,;11.7,1.66,;11.17,3.11,;9.64,3.06,;9.21,1.58,;9.31,-3.19,;10.67,-3.9,;11.98,-3.07,;5.79,-6.95,;7.3,-6.73,;8.06,-7.33,;7.86,-5.31,;.21,-8.97,;-1.16,-8.26,;.27,-10.51,)| Show InChI InChI=1S/C54H69N15O9/c1-3-4-14-40(62-30(2)70)48(73)66-43-25-46(71)59-19-10-9-16-39(47(55)72)64-49(74)41(22-34-26-60-38-15-8-7-13-37(34)38)67-52(77)45-24-36(63-54(56)57)28-69(45)53(78)44(21-31-17-18-32-11-5-6-12-33(32)20-31)68-50(75)42(65-51(43)76)23-35-27-58-29-61-35/h5-8,11-13,15,17-18,20,26-27,29,36,39-45,60H,3-4,9-10,14,16,19,21-25,28H2,1-2H3,(H2,55,72)(H,58,61)(H,59,71)(H,62,70)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,75)(H4,56,57,63)/t36-,39-,40-,41-,42-,43-,44+,45-/m0/s1 | PDB
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PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268792
(AC-Nle-c[Asp-His-DPhe-Pro-Trp-Lys]-NH2 | CHEMBL501...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r| Show InChI InChI=1S/C49H64N12O9/c1-3-4-16-36(55-29(2)62)44(65)58-39-25-42(63)52-20-11-10-18-35(43(50)64)56-45(66)37(23-31-26-53-34-17-9-8-15-33(31)34)59-48(69)41-19-12-21-61(41)49(70)40(22-30-13-6-5-7-14-30)60-46(67)38(57-47(39)68)24-32-27-51-28-54-32/h5-9,13-15,17,26-28,35-41,53H,3-4,10-12,16,18-25H2,1-2H3,(H2,50,64)(H,51,54)(H,52,63)(H,55,62)(H,56,66)(H,57,68)(H,58,65)(H,59,69)(H,60,67)/t35-,36-,37-,38-,39-,40+,41-/m0/s1 | PDB
KEGG
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PubMed
| n/a | n/a | n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268794
(Ac-Nle-c[Asp-His-DPhe-cis-4-guanidinyl-Pro-Trp-Lys...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.76,12.11,41.72,4.4,wD:57.61,25.25,39.45,(20.33,-40.8,;18.97,-40.08,;18.92,-38.54,;17.56,-37.81,;17.51,-36.27,;18.82,-35.46,;18.77,-33.92,;20.08,-33.11,;17.41,-33.19,;16.15,-35.55,;16.1,-34.01,;14.85,-36.36,;13.49,-35.64,;12.18,-36.45,;12.23,-37.99,;13.59,-38.71,;10.92,-38.8,;9.56,-38.08,;8.26,-38.89,;6.9,-38.17,;5.59,-38.98,;4.23,-38.25,;4.18,-36.71,;2.82,-35.99,;1.52,-36.8,;2.77,-34.45,;1.41,-33.72,;1.36,-32.19,;2.59,-31.24,;2.06,-29.79,;.52,-29.85,;-.55,-28.75,;-2.04,-29.13,;-2.45,-30.61,;-1.37,-31.7,;.1,-31.32,;4.08,-33.64,;4.74,-34.72,;5.06,-36.27,;5.44,-34.36,;6.06,-35.94,;7.6,-35.89,;8.02,-34.41,;6.75,-33.55,;6.7,-32.01,;5.34,-31.28,;8,-31.2,;7.95,-29.66,;6.59,-28.93,;6.55,-27.39,;5.19,-26.67,;3.88,-27.48,;3.94,-29.03,;5.29,-29.75,;9.36,-31.92,;10.67,-31.11,;10.62,-29.57,;12.03,-31.83,;13.33,-31.02,;13.29,-29.48,;14.51,-28.54,;14,-27.09,;12.46,-27.13,;12.02,-28.61,;12.08,-33.37,;13.44,-34.1,;14.74,-33.28,;8.54,-37.11,;10.04,-36.73,;10.8,-37.54,;10.65,-35.47,;2.93,-39.07,;1.57,-38.34,;2.98,-40.61,)| Show InChI InChI=1S/C50H67N15O9/c1-3-4-15-36(58-28(2)66)44(69)62-39-23-42(67)55-18-11-10-17-35(43(51)68)60-45(70)37(20-30-24-56-34-16-9-8-14-33(30)34)63-48(73)41-22-32(59-50(52)53)26-65(41)49(74)40(19-29-12-6-5-7-13-29)64-46(71)38(61-47(39)72)21-31-25-54-27-57-31/h5-9,12-14,16,24-25,27,32,35-41,56H,3-4,10-11,15,17-23,26H2,1-2H3,(H2,51,68)(H,54,57)(H,55,67)(H,58,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)(H4,52,53,59)/t32-,35-,36-,37-,38-,39-,40+,41+/m0/s1 | PDB
KEGG
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PubMed
| n/a | n/a | n/a | n/a | 760 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268802
(Ac-Nle-c[Asp-cis-4-guanidinyl-Pro-DNal(2')-Arg-Trp...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2C[C@@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,12.11,21.81,50.52,wD:25.25,39.41,65.73,67.77,(39.57,-47.74,;38.21,-47.02,;38.16,-45.48,;36.8,-44.75,;36.75,-43.21,;38.06,-42.4,;38,-40.86,;39.31,-40.04,;36.65,-40.13,;35.39,-42.49,;35.34,-40.95,;34.08,-43.3,;32.72,-42.58,;31.42,-43.39,;31.47,-44.93,;32.83,-45.65,;30.16,-45.74,;28.8,-45.02,;27.49,-45.83,;26.13,-45.1,;24.82,-45.91,;23.47,-45.19,;23.42,-43.65,;22.06,-42.92,;20.75,-43.74,;22.01,-41.38,;20.63,-40.65,;19.18,-41.16,;17.92,-40.26,;16.69,-41.18,;17.19,-42.65,;16.46,-44,;17.25,-45.3,;18.8,-45.26,;19.52,-43.91,;18.73,-42.62,;23.31,-40.57,;24.63,-40.8,;25.96,-41.59,;23.26,-39.03,;21.9,-38.31,;21.85,-36.77,;20.5,-36.04,;20.44,-34.5,;19.08,-33.78,;19.04,-32.24,;17.77,-34.59,;24.57,-38.22,;25.93,-38.94,;25.98,-40.48,;27.24,-38.13,;27.19,-36.59,;25.83,-35.86,;24.52,-36.68,;23.17,-35.96,;23.11,-34.42,;21.76,-33.69,;21.71,-32.15,;23.02,-31.33,;24.38,-32.07,;24.43,-33.61,;25.78,-34.33,;28.59,-38.85,;29.91,-38.05,;29.86,-36.5,;31.27,-38.78,;32.35,-37.67,;33.85,-38.07,;33.84,-39.61,;31.31,-40.3,;32.67,-41.04,;33.98,-40.22,;35.07,-37.14,;34.87,-35.61,;33.45,-35.01,;36.1,-34.67,;22.16,-46,;20.8,-45.28,;22.21,-47.54,)| Show InChI InChI=1S/C54H74N16O9/c1-3-4-15-39(63-30(2)71)47(74)69-43-27-45(72)60-21-10-9-17-38(46(55)73)65-50(77)42(25-34-28-62-37-16-8-7-14-36(34)37)67-48(75)40(18-11-22-61-53(56)57)66-49(76)41(24-31-19-20-32-12-5-6-13-33(32)23-31)68-51(78)44-26-35(64-54(58)59)29-70(44)52(43)79/h5-8,12-14,16,19-20,23,28,35,38-44,62H,3-4,9-11,15,17-18,21-22,24-27,29H2,1-2H3,(H2,55,73)(H,60,72)(H,63,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,56,57,61)(H4,58,59,64)/t35-,38-,39-,40-,41+,42-,43-,44-/m0/s1 | PDB
UniProtKB/SwissProt
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PC cid
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PubMed
| n/a | n/a | n/a | n/a | 85 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268792
(AC-Nle-c[Asp-His-DPhe-Pro-Trp-Lys]-NH2 | CHEMBL501...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r| Show InChI InChI=1S/C49H64N12O9/c1-3-4-16-36(55-29(2)62)44(65)58-39-25-42(63)52-20-11-10-18-35(43(50)64)56-45(66)37(23-31-26-53-34-17-9-8-15-33(31)34)59-48(69)41-19-12-21-61(41)49(70)40(22-30-13-6-5-7-14-30)60-46(67)38(57-47(39)68)24-32-27-51-28-54-32/h5-9,13-15,17,26-28,35-41,53H,3-4,10-12,16,18-25H2,1-2H3,(H2,50,64)(H,51,54)(H,52,63)(H,55,62)(H,56,66)(H,57,68)(H,58,65)(H,59,69)(H,60,67)/t35-,36-,37-,38-,39-,40+,41-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC3R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268805
(Ac-Tyr-Val-Nle-Gly-His-DPhe-trans-Xaa-Trp-Asp-Arg-...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O)N=C(N)N |r,wU:8.8,45.46,59.63,96.101,35.35,77.82,wD:4.4,57.117,12.21,63.66,85.90,(3.89,-26.77,;2.57,-27.55,;1.22,-26.79,;-.1,-27.57,;-1.45,-26.81,;-2.78,-27.6,;-2.76,-29.14,;-1.41,-29.89,;-4.09,-29.92,;-4.07,-31.46,;-5.4,-32.25,;-6.73,-31.49,;-5.38,-33.78,;-4.04,-34.54,;-2.72,-33.75,;-2.73,-32.22,;-1.4,-31.43,;-.06,-32.19,;1.27,-31.4,;-.04,-33.74,;-1.37,-34.52,;-6.71,-34.57,;-6.71,-36.11,;-8.02,-36.89,;-5.35,-36.86,;-5.43,-29.17,;-5.44,-27.63,;-6.74,-29.95,;-1.46,-25.28,;-2.8,-24.52,;-.14,-24.49,;-.16,-22.95,;1.17,-22.16,;2.52,-22.92,;1.16,-20.62,;2.48,-19.84,;2.46,-18.3,;1.13,-17.55,;.96,-16.02,;-.56,-15.71,;-1.31,-17.05,;-.27,-18.18,;3.82,-20.6,;3.85,-22.14,;5.15,-19.82,;6.5,-20.57,;6.51,-22.12,;7.85,-22.87,;7.87,-24.42,;9.21,-25.18,;10.53,-24.39,;10.51,-22.85,;9.17,-22.09,;7.86,-19.86,;9.11,-20.76,;7.93,-18.32,;6.9,-17.17,;7.69,-15.84,;9.19,-16.18,;9.34,-17.71,;10.66,-18.5,;10.65,-20.04,;12,-17.74,;13.32,-18.54,;13.31,-20.08,;14.59,-20.94,;16.03,-20.4,;16.98,-21.61,;16.14,-22.89,;16.51,-24.38,;15.41,-25.47,;13.93,-25.05,;13.55,-23.56,;14.65,-22.48,;14.67,-17.78,;14.68,-16.24,;15.99,-18.57,;17.33,-17.82,;17.34,-16.27,;18.68,-15.52,;20.02,-16.29,;18.7,-13.97,;18.66,-18.59,;18.64,-20.14,;20,-17.84,;21.32,-18.63,;21.3,-20.18,;22.62,-20.95,;22.61,-22.5,;23.94,-23.27,;23.91,-24.81,;22.59,-25.56,;25.26,-25.58,;22.66,-17.88,;22.67,-16.34,;23.99,-18.65,;25.33,-17.89,;25.35,-16.35,;26.69,-15.6,;28.02,-16.38,;29.36,-15.63,;29.38,-14.09,;28.05,-13.3,;26.71,-14.06,;26.66,-18.67,;26.64,-20.22,;28,-17.92,;29.32,-18.7,;30.66,-17.95,;31.99,-18.73,;30.68,-16.41,;7.08,-14.43,;7.99,-13.19,;7.38,-11.78,;9.52,-13.37,)| Show InChI InChI=1S/C77H102N22O16/c1-5-6-21-53(93-74(114)65(42(2)3)98-72(112)56(89-43(4)100)30-46-24-26-50(101)27-25-46)66(106)87-39-63(103)91-58(33-48-37-83-41-88-48)70(110)97-60(31-45-18-11-8-12-19-45)75(115)99-40-49(90-77(81)82)34-61(99)73(113)96-57(32-47-36-85-52-22-14-13-20-51(47)52)69(109)95-59(35-64(104)105)71(111)92-54(23-15-28-84-76(79)80)68(108)94-55(67(107)86-38-62(78)102)29-44-16-9-7-10-17-44/h7-14,16-20,22,24-27,36-37,41-42,49,53-61,65,85,101H,5-6,15,21,23,28-35,38-40H2,1-4H3,(H2,78,102)(H,83,88)(H,86,107)(H,87,106)(H,89,100)(H,91,103)(H,92,111)(H,93,114)(H,94,108)(H,95,109)(H,96,113)(H,97,110)(H,98,112)(H,104,105)(H4,79,80,84)(H4,81,82,90)/t49-,53+,54+,55+,56+,57+,58+,59+,60-,61+,65+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC4R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268799
(Ac-Nle-c[Asp-His-DNal(2')-trans-4-guanidinyl-Pro-T...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.81,12.11,4.4,41.77,39.45,wD:61.66,25.25,(17.63,-10.54,;16.26,-9.83,;16.2,-8.29,;14.83,-7.58,;14.77,-6.04,;16.07,-5.21,;16,-3.68,;17.31,-2.85,;14.64,-2.96,;13.4,-5.33,;13.34,-3.79,;12.11,-6.15,;10.74,-5.44,;9.44,-6.27,;9.5,-7.81,;10.87,-8.52,;8.21,-8.64,;6.84,-7.92,;5.54,-8.75,;4.17,-8.03,;2.88,-8.86,;1.51,-8.15,;1.44,-6.61,;.08,-5.89,;-1.22,-6.72,;.01,-4.36,;-1.35,-3.64,;-1.42,-2.1,;-.2,-1.15,;-.74,.29,;-2.29,.23,;-3.36,1.32,;-4.84,.92,;-5.24,-.57,;-4.16,-1.64,;-2.69,-1.26,;1.32,-3.53,;1.98,-4.61,;2.31,-6.15,;2.67,-4.24,;3.31,-5.82,;4.85,-5.75,;5.26,-4.27,;3.98,-3.42,;3.91,-1.88,;2.55,-1.17,;5.21,-1.05,;5.15,.48,;3.78,1.2,;2.49,.37,;1.12,1.07,;1.05,2.62,;-.31,3.33,;-.37,4.87,;.93,5.7,;2.3,4.98,;2.36,3.44,;3.72,2.73,;6.58,-1.77,;7.88,-.94,;7.81,.6,;9.24,-1.65,;10.54,-.82,;10.49,.72,;11.7,1.66,;11.17,3.11,;9.64,3.06,;9.21,1.58,;9.31,-3.19,;10.67,-3.9,;11.98,-3.07,;5.79,-6.95,;7.3,-6.73,;8.06,-7.33,;7.86,-5.31,;.21,-8.97,;-1.16,-8.26,;.27,-10.51,)| Show InChI InChI=1S/C54H69N15O9/c1-3-4-14-40(62-30(2)70)48(73)66-43-25-46(71)59-19-10-9-16-39(47(55)72)64-49(74)41(22-34-26-60-38-15-8-7-13-37(34)38)67-52(77)45-24-36(63-54(56)57)28-69(45)53(78)44(21-31-17-18-32-11-5-6-12-33(32)20-31)68-50(75)42(65-51(43)76)23-35-27-58-29-61-35/h5-8,11-13,15,17-18,20,26-27,29,36,39-45,60H,3-4,9-10,14,16,19,21-25,28H2,1-2H3,(H2,55,72)(H,58,61)(H,59,71)(H,62,70)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,75)(H4,56,57,63)/t36-,39-,40-,41-,42-,43-,44+,45-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 620 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC3R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268802
(Ac-Nle-c[Asp-cis-4-guanidinyl-Pro-DNal(2')-Arg-Trp...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2C[C@@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,12.11,21.81,50.52,wD:25.25,39.41,65.73,67.77,(39.57,-47.74,;38.21,-47.02,;38.16,-45.48,;36.8,-44.75,;36.75,-43.21,;38.06,-42.4,;38,-40.86,;39.31,-40.04,;36.65,-40.13,;35.39,-42.49,;35.34,-40.95,;34.08,-43.3,;32.72,-42.58,;31.42,-43.39,;31.47,-44.93,;32.83,-45.65,;30.16,-45.74,;28.8,-45.02,;27.49,-45.83,;26.13,-45.1,;24.82,-45.91,;23.47,-45.19,;23.42,-43.65,;22.06,-42.92,;20.75,-43.74,;22.01,-41.38,;20.63,-40.65,;19.18,-41.16,;17.92,-40.26,;16.69,-41.18,;17.19,-42.65,;16.46,-44,;17.25,-45.3,;18.8,-45.26,;19.52,-43.91,;18.73,-42.62,;23.31,-40.57,;24.63,-40.8,;25.96,-41.59,;23.26,-39.03,;21.9,-38.31,;21.85,-36.77,;20.5,-36.04,;20.44,-34.5,;19.08,-33.78,;19.04,-32.24,;17.77,-34.59,;24.57,-38.22,;25.93,-38.94,;25.98,-40.48,;27.24,-38.13,;27.19,-36.59,;25.83,-35.86,;24.52,-36.68,;23.17,-35.96,;23.11,-34.42,;21.76,-33.69,;21.71,-32.15,;23.02,-31.33,;24.38,-32.07,;24.43,-33.61,;25.78,-34.33,;28.59,-38.85,;29.91,-38.05,;29.86,-36.5,;31.27,-38.78,;32.35,-37.67,;33.85,-38.07,;33.84,-39.61,;31.31,-40.3,;32.67,-41.04,;33.98,-40.22,;35.07,-37.14,;34.87,-35.61,;33.45,-35.01,;36.1,-34.67,;22.16,-46,;20.8,-45.28,;22.21,-47.54,)| Show InChI InChI=1S/C54H74N16O9/c1-3-4-15-39(63-30(2)71)47(74)69-43-27-45(72)60-21-10-9-17-38(46(55)73)65-50(77)42(25-34-28-62-37-16-8-7-14-36(34)37)67-48(75)40(18-11-22-61-53(56)57)66-49(76)41(24-31-19-20-32-12-5-6-13-33(32)23-31)68-51(78)44-26-35(64-54(58)59)29-70(44)52(43)79/h5-8,12-14,16,19-20,23,28,35,38-44,62H,3-4,9-11,15,17-18,21-22,24-27,29H2,1-2H3,(H2,55,73)(H,60,72)(H,63,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,56,57,61)(H4,58,59,64)/t35-,38-,39-,40-,41+,42-,43-,44-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC3R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268803
(Ac-Tyr-Val-Nle-Gly-His-DPhe-cis-Xaa-Trp-Asp-Arg-Ph...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O)N=C(N)N |r,wU:8.8,45.46,59.63,57.117,96.101,35.35,77.82,wD:4.4,12.21,63.66,85.90,(2.53,-50.05,;1.21,-50.83,;-.13,-50.07,;-1.45,-50.85,;-2.8,-50.09,;-4.13,-50.88,;-4.11,-52.42,;-2.77,-53.17,;-5.44,-53.2,;-5.43,-54.75,;-6.75,-55.53,;-8.09,-54.77,;-6.74,-57.06,;-5.4,-57.82,;-4.07,-57.04,;-4.09,-55.5,;-2.76,-54.71,;-1.41,-55.47,;-.08,-54.68,;-1.39,-57.02,;-2.73,-57.8,;-8.07,-57.85,;-8.06,-59.39,;-9.38,-60.18,;-6.71,-60.14,;-6.78,-52.45,;-6.8,-50.91,;-8.1,-53.23,;-2.82,-48.56,;-4.16,-47.8,;-1.49,-47.77,;-1.51,-46.23,;-.18,-45.44,;1.17,-46.2,;-.2,-43.9,;1.13,-43.12,;1.11,-41.58,;-.23,-40.83,;-.4,-39.3,;-1.91,-38.99,;-2.66,-40.33,;-1.63,-41.47,;2.47,-43.88,;2.49,-45.42,;3.8,-43.1,;5.14,-43.85,;5.16,-45.4,;6.5,-46.15,;6.51,-47.7,;7.85,-48.46,;9.17,-47.68,;9.16,-46.14,;7.81,-45.37,;6.5,-43.14,;7.76,-44.04,;6.57,-41.61,;5.55,-40.45,;6.33,-39.12,;7.84,-39.46,;7.99,-40.99,;9.31,-41.78,;9.3,-43.32,;10.65,-41.02,;11.97,-41.82,;11.95,-43.36,;13.23,-44.22,;14.68,-43.68,;15.63,-44.89,;14.78,-46.18,;15.16,-47.67,;14.06,-48.75,;12.58,-48.33,;12.19,-46.84,;13.3,-45.76,;13.31,-41.06,;13.32,-39.52,;14.64,-41.85,;15.98,-41.1,;15.99,-39.56,;17.33,-38.8,;18.67,-39.57,;17.35,-37.26,;17.3,-41.87,;17.29,-43.42,;18.65,-41.12,;19.96,-41.91,;19.94,-43.46,;21.27,-44.24,;21.26,-45.78,;22.59,-46.55,;22.56,-48.09,;21.24,-48.84,;23.9,-48.86,;21.3,-41.16,;21.31,-39.62,;22.64,-41.93,;23.98,-41.17,;23.99,-39.64,;25.33,-38.88,;26.66,-39.66,;28.01,-38.91,;28.02,-37.37,;26.7,-36.58,;25.36,-37.34,;25.31,-41.95,;25.29,-43.5,;26.65,-41.2,;27.97,-41.99,;29.31,-41.23,;30.64,-42.01,;29.32,-39.69,;5.72,-37.71,;6.64,-36.47,;6.03,-35.06,;8.17,-36.65,)| Show InChI InChI=1S/C77H102N22O16/c1-5-6-21-53(93-74(114)65(42(2)3)98-72(112)56(89-43(4)100)30-46-24-26-50(101)27-25-46)66(106)87-39-63(103)91-58(33-48-37-83-41-88-48)70(110)97-60(31-45-18-11-8-12-19-45)75(115)99-40-49(90-77(81)82)34-61(99)73(113)96-57(32-47-36-85-52-22-14-13-20-51(47)52)69(109)95-59(35-64(104)105)71(111)92-54(23-15-28-84-76(79)80)68(108)94-55(67(107)86-38-62(78)102)29-44-16-9-7-10-17-44/h7-14,16-20,22,24-27,36-37,41-42,49,53-61,65,85,101H,5-6,15,21,23,28-35,38-40H2,1-4H3,(H2,78,102)(H,83,88)(H,86,107)(H,87,106)(H,89,100)(H,91,103)(H,92,111)(H,93,114)(H,94,108)(H,95,109)(H,96,113)(H,97,110)(H,98,112)(H,104,105)(H4,79,80,84)(H4,81,82,90)/t49-,53-,54-,55-,56-,57-,58-,59-,60+,61-,65-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC3R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268803
(Ac-Tyr-Val-Nle-Gly-His-DPhe-cis-Xaa-Trp-Asp-Arg-Ph...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O)N=C(N)N |r,wU:8.8,45.46,59.63,57.117,96.101,35.35,77.82,wD:4.4,12.21,63.66,85.90,(2.53,-50.05,;1.21,-50.83,;-.13,-50.07,;-1.45,-50.85,;-2.8,-50.09,;-4.13,-50.88,;-4.11,-52.42,;-2.77,-53.17,;-5.44,-53.2,;-5.43,-54.75,;-6.75,-55.53,;-8.09,-54.77,;-6.74,-57.06,;-5.4,-57.82,;-4.07,-57.04,;-4.09,-55.5,;-2.76,-54.71,;-1.41,-55.47,;-.08,-54.68,;-1.39,-57.02,;-2.73,-57.8,;-8.07,-57.85,;-8.06,-59.39,;-9.38,-60.18,;-6.71,-60.14,;-6.78,-52.45,;-6.8,-50.91,;-8.1,-53.23,;-2.82,-48.56,;-4.16,-47.8,;-1.49,-47.77,;-1.51,-46.23,;-.18,-45.44,;1.17,-46.2,;-.2,-43.9,;1.13,-43.12,;1.11,-41.58,;-.23,-40.83,;-.4,-39.3,;-1.91,-38.99,;-2.66,-40.33,;-1.63,-41.47,;2.47,-43.88,;2.49,-45.42,;3.8,-43.1,;5.14,-43.85,;5.16,-45.4,;6.5,-46.15,;6.51,-47.7,;7.85,-48.46,;9.17,-47.68,;9.16,-46.14,;7.81,-45.37,;6.5,-43.14,;7.76,-44.04,;6.57,-41.61,;5.55,-40.45,;6.33,-39.12,;7.84,-39.46,;7.99,-40.99,;9.31,-41.78,;9.3,-43.32,;10.65,-41.02,;11.97,-41.82,;11.95,-43.36,;13.23,-44.22,;14.68,-43.68,;15.63,-44.89,;14.78,-46.18,;15.16,-47.67,;14.06,-48.75,;12.58,-48.33,;12.19,-46.84,;13.3,-45.76,;13.31,-41.06,;13.32,-39.52,;14.64,-41.85,;15.98,-41.1,;15.99,-39.56,;17.33,-38.8,;18.67,-39.57,;17.35,-37.26,;17.3,-41.87,;17.29,-43.42,;18.65,-41.12,;19.96,-41.91,;19.94,-43.46,;21.27,-44.24,;21.26,-45.78,;22.59,-46.55,;22.56,-48.09,;21.24,-48.84,;23.9,-48.86,;21.3,-41.16,;21.31,-39.62,;22.64,-41.93,;23.98,-41.17,;23.99,-39.64,;25.33,-38.88,;26.66,-39.66,;28.01,-38.91,;28.02,-37.37,;26.7,-36.58,;25.36,-37.34,;25.31,-41.95,;25.29,-43.5,;26.65,-41.2,;27.97,-41.99,;29.31,-41.23,;30.64,-42.01,;29.32,-39.69,;5.72,-37.71,;6.64,-36.47,;6.03,-35.06,;8.17,-36.65,)| Show InChI InChI=1S/C77H102N22O16/c1-5-6-21-53(93-74(114)65(42(2)3)98-72(112)56(89-43(4)100)30-46-24-26-50(101)27-25-46)66(106)87-39-63(103)91-58(33-48-37-83-41-88-48)70(110)97-60(31-45-18-11-8-12-19-45)75(115)99-40-49(90-77(81)82)34-61(99)73(113)96-57(32-47-36-85-52-22-14-13-20-51(47)52)69(109)95-59(35-64(104)105)71(111)92-54(23-15-28-84-76(79)80)68(108)94-55(67(107)86-38-62(78)102)29-44-16-9-7-10-17-44/h7-14,16-20,22,24-27,36-37,41-42,49,53-61,65,85,101H,5-6,15,21,23,28-35,38-40H2,1-4H3,(H2,78,102)(H,83,88)(H,86,107)(H,87,106)(H,89,100)(H,91,103)(H,92,111)(H,93,114)(H,94,108)(H,95,109)(H,96,113)(H,97,110)(H,98,112)(H,104,105)(H4,79,80,84)(H4,81,82,90)/t49-,53-,54-,55-,56-,57-,58-,59-,60+,61-,65-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268805
(Ac-Tyr-Val-Nle-Gly-His-DPhe-trans-Xaa-Trp-Asp-Arg-...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O)N=C(N)N |r,wU:8.8,45.46,59.63,96.101,35.35,77.82,wD:4.4,57.117,12.21,63.66,85.90,(3.89,-26.77,;2.57,-27.55,;1.22,-26.79,;-.1,-27.57,;-1.45,-26.81,;-2.78,-27.6,;-2.76,-29.14,;-1.41,-29.89,;-4.09,-29.92,;-4.07,-31.46,;-5.4,-32.25,;-6.73,-31.49,;-5.38,-33.78,;-4.04,-34.54,;-2.72,-33.75,;-2.73,-32.22,;-1.4,-31.43,;-.06,-32.19,;1.27,-31.4,;-.04,-33.74,;-1.37,-34.52,;-6.71,-34.57,;-6.71,-36.11,;-8.02,-36.89,;-5.35,-36.86,;-5.43,-29.17,;-5.44,-27.63,;-6.74,-29.95,;-1.46,-25.28,;-2.8,-24.52,;-.14,-24.49,;-.16,-22.95,;1.17,-22.16,;2.52,-22.92,;1.16,-20.62,;2.48,-19.84,;2.46,-18.3,;1.13,-17.55,;.96,-16.02,;-.56,-15.71,;-1.31,-17.05,;-.27,-18.18,;3.82,-20.6,;3.85,-22.14,;5.15,-19.82,;6.5,-20.57,;6.51,-22.12,;7.85,-22.87,;7.87,-24.42,;9.21,-25.18,;10.53,-24.39,;10.51,-22.85,;9.17,-22.09,;7.86,-19.86,;9.11,-20.76,;7.93,-18.32,;6.9,-17.17,;7.69,-15.84,;9.19,-16.18,;9.34,-17.71,;10.66,-18.5,;10.65,-20.04,;12,-17.74,;13.32,-18.54,;13.31,-20.08,;14.59,-20.94,;16.03,-20.4,;16.98,-21.61,;16.14,-22.89,;16.51,-24.38,;15.41,-25.47,;13.93,-25.05,;13.55,-23.56,;14.65,-22.48,;14.67,-17.78,;14.68,-16.24,;15.99,-18.57,;17.33,-17.82,;17.34,-16.27,;18.68,-15.52,;20.02,-16.29,;18.7,-13.97,;18.66,-18.59,;18.64,-20.14,;20,-17.84,;21.32,-18.63,;21.3,-20.18,;22.62,-20.95,;22.61,-22.5,;23.94,-23.27,;23.91,-24.81,;22.59,-25.56,;25.26,-25.58,;22.66,-17.88,;22.67,-16.34,;23.99,-18.65,;25.33,-17.89,;25.35,-16.35,;26.69,-15.6,;28.02,-16.38,;29.36,-15.63,;29.38,-14.09,;28.05,-13.3,;26.71,-14.06,;26.66,-18.67,;26.64,-20.22,;28,-17.92,;29.32,-18.7,;30.66,-17.95,;31.99,-18.73,;30.68,-16.41,;7.08,-14.43,;7.99,-13.19,;7.38,-11.78,;9.52,-13.37,)| Show InChI InChI=1S/C77H102N22O16/c1-5-6-21-53(93-74(114)65(42(2)3)98-72(112)56(89-43(4)100)30-46-24-26-50(101)27-25-46)66(106)87-39-63(103)91-58(33-48-37-83-41-88-48)70(110)97-60(31-45-18-11-8-12-19-45)75(115)99-40-49(90-77(81)82)34-61(99)73(113)96-57(32-47-36-85-52-22-14-13-20-51(47)52)69(109)95-59(35-64(104)105)71(111)92-54(23-15-28-84-76(79)80)68(108)94-55(67(107)86-38-62(78)102)29-44-16-9-7-10-17-44/h7-14,16-20,22,24-27,36-37,41-42,49,53-61,65,85,101H,5-6,15,21,23,28-35,38-40H2,1-4H3,(H2,78,102)(H,83,88)(H,86,107)(H,87,106)(H,89,100)(H,91,103)(H,92,111)(H,93,114)(H,94,108)(H,95,109)(H,96,113)(H,97,110)(H,98,112)(H,104,105)(H4,79,80,84)(H4,81,82,90)/t49-,53+,54+,55+,56+,57+,58+,59+,60-,61+,65+/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC3R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50184359
((3S,6S,9R,12S,15S,23S)-15-((S)-2-acetylamino-hexan...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r,wU:21.75,50.52,12.11,4.4,39.41,wD:25.25,61.64,(19.68,-11.7,;18.32,-10.97,;18.27,-9.43,;16.91,-8.71,;16.86,-7.17,;18.17,-6.36,;18.11,-4.82,;19.42,-4,;16.76,-4.09,;15.5,-6.44,;15.45,-4.9,;14.19,-7.26,;12.83,-6.53,;11.53,-7.35,;11.58,-8.88,;12.94,-9.61,;10.27,-9.7,;8.91,-8.97,;7.6,-9.79,;6.25,-9.06,;4.94,-9.87,;3.58,-9.15,;3.53,-7.61,;2.17,-6.88,;.86,-7.7,;2.12,-5.35,;.76,-4.62,;.71,-3.08,;1.93,-2.14,;1.41,-.69,;-.14,-.74,;-1.21,.35,;-2.69,-.02,;-3.1,-1.51,;-2.03,-2.6,;-.56,-2.22,;3.43,-4.53,;4.79,-5.26,;4.84,-6.8,;6.98,-5.22,;8.76,-4.36,;10.12,-5.08,;10.17,-6.62,;8.86,-7.43,;7.5,-6.71,;6.19,-7.52,;8.83,-5.93,;6.09,-4.44,;6.04,-2.9,;4.68,-2.18,;7.35,-2.09,;7.3,-.55,;5.94,.17,;5.89,1.71,;4.53,2.44,;3.23,1.62,;3.28,.07,;4.64,-.64,;8.71,-2.82,;10.02,-2,;9.96,-.46,;11.37,-2.73,;12.68,-1.91,;12.64,-.37,;13.86,.56,;13.35,2.01,;11.81,1.97,;11.37,.5,;11.42,-4.27,;12.78,-4.99,;14.09,-4.18,;2.27,-9.96,;.91,-9.24,;2.32,-11.5,)| Show InChI InChI=1S/C50H69N15O9/c1-3-4-16-36(59-29(2)66)44(69)65-41-25-42(67)55-20-11-10-18-35(43(51)68)60-47(72)39(23-31-26-57-34-17-9-8-15-33(31)34)63-45(70)37(19-12-21-56-50(52)53)61-46(71)38(22-30-13-6-5-7-14-30)62-48(73)40(64-49(41)74)24-32-27-54-28-58-32/h5-9,13-15,17,26-28,35-41,57H,3-4,10-12,16,18-25H2,1-2H3,(H2,51,68)(H,54,58)(H,55,67)(H,59,66)(H,60,72)(H,61,71)(H,62,73)(H,63,70)(H,64,74)(H,65,69)(H4,52,53,56)/t35-,36-,37-,38+,39-,40-,41-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.30 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268804
(Ac-Tyr-Val-Nle-Gly-His-DPhe-Pro-Trp-Asp-Arg-Phe-Gl...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r,wU:8.8,45.46,59.63,96.101,35.35,77.82,wD:4.4,12.21,63.66,85.90,(2.68,-6.73,;1.36,-7.52,;.01,-6.75,;-1.31,-7.53,;-2.65,-6.78,;-3.99,-7.57,;-3.97,-9.11,;-2.62,-9.86,;-5.3,-9.89,;-5.28,-11.43,;-6.61,-12.22,;-7.94,-11.46,;-6.59,-13.75,;-5.25,-14.51,;-3.92,-13.72,;-3.94,-12.19,;-2.61,-11.4,;-1.26,-12.16,;.06,-11.37,;-1.25,-13.71,;-2.58,-14.49,;-7.92,-14.54,;-7.92,-16.08,;-9.23,-16.86,;-6.56,-16.83,;-6.64,-9.14,;-6.65,-7.59,;-7.95,-9.92,;-2.67,-5.24,;-4.01,-4.49,;-1.35,-4.46,;-1.37,-2.92,;-.03,-2.13,;1.32,-2.89,;-.05,-.59,;1.27,.2,;1.26,1.73,;-.08,2.49,;-.25,4.02,;-1.77,4.33,;-2.52,2.99,;-1.48,1.85,;2.62,-.57,;2.64,-2.11,;3.94,.22,;5.29,-.54,;5.31,-2.09,;6.64,-2.84,;6.66,-4.39,;8,-5.15,;9.32,-4.36,;9.3,-2.82,;7.96,-2.06,;6.65,.17,;7.9,-.73,;6.72,1.71,;5.7,2.87,;6.48,4.19,;7.98,3.86,;8.13,2.32,;9.45,1.54,;9.44,-0,;10.8,2.29,;12.11,1.49,;12.1,-.05,;13.38,-.9,;14.82,-.37,;15.78,-1.58,;14.93,-2.86,;15.31,-4.35,;14.21,-5.43,;12.73,-5.02,;12.34,-3.52,;13.44,-2.45,;13.46,2.25,;13.47,3.79,;14.78,1.46,;16.13,2.22,;16.14,3.76,;17.48,4.52,;18.82,3.75,;17.5,6.06,;17.45,1.44,;17.43,-.1,;18.79,2.2,;20.11,1.4,;20.09,-.14,;21.42,-.92,;21.41,-2.46,;22.74,-3.24,;22.71,-4.78,;21.38,-5.53,;24.05,-5.55,;21.45,2.16,;21.46,3.7,;22.79,1.39,;24.13,2.15,;24.14,3.68,;25.48,4.44,;26.81,3.66,;28.16,4.41,;28.17,5.95,;26.84,6.74,;25.51,5.98,;25.46,1.36,;25.44,-.18,;26.8,2.12,;28.12,1.33,;29.46,2.09,;30.79,1.3,;29.47,3.63,)| Show InChI InChI=1S/C76H99N19O16/c1-5-6-22-53(89-74(110)65(43(2)3)94-72(108)56(86-44(4)96)33-47-26-28-50(97)29-27-47)66(102)84-41-63(99)87-58(36-49-39-80-42-85-49)70(106)93-60(34-46-19-11-8-12-20-46)75(111)95-31-16-25-61(95)73(109)92-57(35-48-38-82-52-23-14-13-21-51(48)52)69(105)91-59(37-64(100)101)71(107)88-54(24-15-30-81-76(78)79)68(104)90-55(67(103)83-40-62(77)98)32-45-17-9-7-10-18-45/h7-14,17-21,23,26-29,38-39,42-43,53-61,65,82,97H,5-6,15-16,22,24-25,30-37,40-41H2,1-4H3,(H2,77,98)(H,80,85)(H,83,103)(H,84,102)(H,86,96)(H,87,99)(H,88,107)(H,89,110)(H,90,104)(H,91,105)(H,92,109)(H,93,106)(H,94,108)(H,100,101)(H4,78,79,81)/t53-,54-,55-,56-,57-,58-,59-,60+,61-,65-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 120 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268805
(Ac-Tyr-Val-Nle-Gly-His-DPhe-trans-Xaa-Trp-Asp-Arg-...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O)N=C(N)N |r,wU:8.8,45.46,59.63,96.101,35.35,77.82,wD:4.4,57.117,12.21,63.66,85.90,(3.89,-26.77,;2.57,-27.55,;1.22,-26.79,;-.1,-27.57,;-1.45,-26.81,;-2.78,-27.6,;-2.76,-29.14,;-1.41,-29.89,;-4.09,-29.92,;-4.07,-31.46,;-5.4,-32.25,;-6.73,-31.49,;-5.38,-33.78,;-4.04,-34.54,;-2.72,-33.75,;-2.73,-32.22,;-1.4,-31.43,;-.06,-32.19,;1.27,-31.4,;-.04,-33.74,;-1.37,-34.52,;-6.71,-34.57,;-6.71,-36.11,;-8.02,-36.89,;-5.35,-36.86,;-5.43,-29.17,;-5.44,-27.63,;-6.74,-29.95,;-1.46,-25.28,;-2.8,-24.52,;-.14,-24.49,;-.16,-22.95,;1.17,-22.16,;2.52,-22.92,;1.16,-20.62,;2.48,-19.84,;2.46,-18.3,;1.13,-17.55,;.96,-16.02,;-.56,-15.71,;-1.31,-17.05,;-.27,-18.18,;3.82,-20.6,;3.85,-22.14,;5.15,-19.82,;6.5,-20.57,;6.51,-22.12,;7.85,-22.87,;7.87,-24.42,;9.21,-25.18,;10.53,-24.39,;10.51,-22.85,;9.17,-22.09,;7.86,-19.86,;9.11,-20.76,;7.93,-18.32,;6.9,-17.17,;7.69,-15.84,;9.19,-16.18,;9.34,-17.71,;10.66,-18.5,;10.65,-20.04,;12,-17.74,;13.32,-18.54,;13.31,-20.08,;14.59,-20.94,;16.03,-20.4,;16.98,-21.61,;16.14,-22.89,;16.51,-24.38,;15.41,-25.47,;13.93,-25.05,;13.55,-23.56,;14.65,-22.48,;14.67,-17.78,;14.68,-16.24,;15.99,-18.57,;17.33,-17.82,;17.34,-16.27,;18.68,-15.52,;20.02,-16.29,;18.7,-13.97,;18.66,-18.59,;18.64,-20.14,;20,-17.84,;21.32,-18.63,;21.3,-20.18,;22.62,-20.95,;22.61,-22.5,;23.94,-23.27,;23.91,-24.81,;22.59,-25.56,;25.26,-25.58,;22.66,-17.88,;22.67,-16.34,;23.99,-18.65,;25.33,-17.89,;25.35,-16.35,;26.69,-15.6,;28.02,-16.38,;29.36,-15.63,;29.38,-14.09,;28.05,-13.3,;26.71,-14.06,;26.66,-18.67,;26.64,-20.22,;28,-17.92,;29.32,-18.7,;30.66,-17.95,;31.99,-18.73,;30.68,-16.41,;7.08,-14.43,;7.99,-13.19,;7.38,-11.78,;9.52,-13.37,)| Show InChI InChI=1S/C77H102N22O16/c1-5-6-21-53(93-74(114)65(42(2)3)98-72(112)56(89-43(4)100)30-46-24-26-50(101)27-25-46)66(106)87-39-63(103)91-58(33-48-37-83-41-88-48)70(110)97-60(31-45-18-11-8-12-19-45)75(115)99-40-49(90-77(81)82)34-61(99)73(113)96-57(32-47-36-85-52-22-14-13-20-51(47)52)69(109)95-59(35-64(104)105)71(111)92-54(23-15-28-84-76(79)80)68(108)94-55(67(107)86-38-62(78)102)29-44-16-9-7-10-17-44/h7-14,16-20,22,24-27,36-37,41-42,49,53-61,65,85,101H,5-6,15,21,23,28-35,38-40H2,1-4H3,(H2,78,102)(H,83,88)(H,86,107)(H,87,106)(H,89,100)(H,91,103)(H,92,111)(H,93,114)(H,94,108)(H,95,109)(H,96,113)(H,97,110)(H,98,112)(H,104,105)(H4,79,80,84)(H4,81,82,90)/t49-,53+,54+,55+,56+,57+,58+,59+,60-,61+,65+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.40E+3 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268793
(Ac-Nle-c[Asp-His-DPhe-trans-4-guanidinyl-Pro-Trp-L...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.76,12.11,41.72,4.4,39.45,wD:57.61,25.25,(17.82,-24,;16.46,-23.28,;16.41,-21.74,;15.05,-21.01,;15,-19.47,;16.31,-18.66,;16.26,-17.12,;17.56,-16.31,;14.9,-16.39,;13.64,-18.75,;13.59,-17.21,;12.33,-19.56,;10.98,-18.84,;9.67,-19.65,;9.72,-21.19,;11.08,-21.91,;8.41,-22,;7.05,-21.28,;5.75,-22.09,;4.39,-21.37,;3.08,-22.18,;1.72,-21.45,;1.67,-19.91,;.31,-19.19,;-1,-20,;.26,-17.65,;-1.1,-16.92,;-1.15,-15.39,;.08,-14.44,;-.45,-12.99,;-2,-13.05,;-3.06,-11.95,;-4.55,-12.33,;-4.96,-13.81,;-3.88,-14.9,;-2.41,-14.52,;1.57,-16.84,;2.22,-17.92,;2.54,-19.47,;2.93,-17.56,;3.55,-19.14,;5.08,-19.09,;5.51,-17.61,;4.23,-16.75,;4.18,-15.21,;2.82,-14.48,;5.49,-14.4,;5.44,-12.86,;4.08,-12.13,;4.03,-10.59,;2.68,-9.87,;1.37,-10.68,;1.42,-12.23,;2.78,-12.95,;6.85,-15.12,;8.16,-14.31,;8.11,-12.77,;9.51,-15.03,;10.82,-14.22,;10.78,-12.68,;12,-11.74,;11.49,-10.29,;9.95,-10.33,;9.51,-11.81,;9.57,-16.57,;10.92,-17.3,;12.23,-16.48,;6.03,-20.31,;7.52,-19.93,;8.28,-20.74,;8.13,-18.67,;.41,-22.27,;-.95,-21.54,;.46,-23.81,)| Show InChI InChI=1S/C50H67N15O9/c1-3-4-15-36(58-28(2)66)44(69)62-39-23-42(67)55-18-11-10-17-35(43(51)68)60-45(70)37(20-30-24-56-34-16-9-8-14-33(30)34)63-48(73)41-22-32(59-50(52)53)26-65(41)49(74)40(19-29-12-6-5-7-13-29)64-46(71)38(61-47(39)72)21-31-25-54-27-57-31/h5-9,12-14,16,24-25,27,32,35-41,56H,3-4,10-11,15,17-23,26H2,1-2H3,(H2,51,68)(H,54,57)(H,55,67)(H,58,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)(H4,52,53,59)/t32-,35-,36-,37-,38-,39-,40+,41-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
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PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | n/a | n/a | 43 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC4R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268801
(Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DNal(2')-Arg-T...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,12.11,67.77,21.81,50.52,wD:25.25,39.41,65.73,(14,-47.54,;12.64,-46.82,;12.59,-45.28,;11.23,-44.55,;11.18,-43.02,;12.48,-42.2,;12.43,-40.66,;13.74,-39.85,;11.08,-39.94,;9.82,-42.29,;9.77,-40.75,;8.51,-43.1,;7.15,-42.38,;5.85,-43.19,;5.9,-44.73,;7.25,-45.46,;4.58,-45.55,;3.23,-44.82,;1.92,-45.64,;.56,-44.9,;-.75,-45.72,;-2.1,-44.99,;-2.16,-43.45,;-3.51,-42.73,;-4.83,-43.54,;-3.56,-41.19,;-4.94,-40.46,;-6.39,-40.96,;-7.65,-40.07,;-8.88,-40.99,;-8.38,-42.46,;-9.11,-43.8,;-8.32,-45.1,;-6.78,-45.06,;-6.05,-43.72,;-6.84,-42.42,;-2.26,-40.37,;-.94,-40.6,;.38,-41.4,;-2.31,-38.83,;-3.67,-38.11,;-3.72,-36.57,;-5.08,-35.85,;-5.13,-34.31,;-6.49,-33.58,;-6.54,-32.04,;-7.8,-34.4,;-1,-38.02,;.36,-38.75,;.41,-40.29,;1.67,-37.93,;1.61,-36.39,;.26,-35.67,;-1.06,-36.48,;-2.41,-35.77,;-2.46,-34.22,;-3.82,-33.49,;-3.87,-31.96,;-2.55,-31.14,;-1.19,-31.87,;-1.15,-33.41,;.21,-34.13,;3.02,-38.66,;4.34,-37.85,;4.28,-36.3,;5.7,-38.58,;6.78,-37.48,;8.27,-37.87,;8.27,-39.41,;5.74,-40.1,;7.1,-40.84,;8.41,-40.03,;9.5,-36.94,;9.3,-35.41,;7.88,-34.82,;10.52,-34.48,;-3.41,-45.81,;-4.77,-45.08,;-3.37,-47.35,)| Show InChI InChI=1S/C54H74N16O9/c1-3-4-15-39(63-30(2)71)47(74)69-43-27-45(72)60-21-10-9-17-38(46(55)73)65-50(77)42(25-34-28-62-37-16-8-7-14-36(34)37)67-48(75)40(18-11-22-61-53(56)57)66-49(76)41(24-31-19-20-32-12-5-6-13-33(32)23-31)68-51(78)44-26-35(64-54(58)59)29-70(44)52(43)79/h5-8,12-14,16,19-20,23,28,35,38-44,62H,3-4,9-11,15,17-18,21-22,24-27,29H2,1-2H3,(H2,55,73)(H,60,72)(H,63,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,56,57,61)(H4,58,59,64)/t35-,38+,39+,40+,41-,42+,43+,44+/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 0.300 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268798
(Ac-Nle-c[Asp-His-DNaI(2')-Pro-Trp-Lys]-NH2 | CHEMB...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r| Show InChI InChI=1S/C53H66N12O9/c1-3-4-15-40(59-31(2)66)48(69)62-43-27-46(67)56-21-10-9-17-39(47(54)68)60-49(70)41(25-35-28-57-38-16-8-7-14-37(35)38)63-52(73)45-18-11-22-65(45)53(74)44(24-32-19-20-33-12-5-6-13-34(33)23-32)64-50(71)42(61-51(43)72)26-36-29-55-30-58-36/h5-8,12-14,16,19-20,23,28-30,39-45,57H,3-4,9-11,15,17-18,21-22,24-27H2,1-2H3,(H2,54,68)(H,55,58)(H,56,67)(H,59,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)/t39-,40-,41-,42-,43-,44+,45-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50268798
(Ac-Nle-c[Asp-His-DNaI(2')-Pro-Trp-Lys]-NH2 | CHEMB...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r| Show InChI InChI=1S/C53H66N12O9/c1-3-4-15-40(59-31(2)66)48(69)62-43-27-46(67)56-21-10-9-17-39(47(54)68)60-49(70)41(25-35-28-57-38-16-8-7-14-37(35)38)63-52(73)45-18-11-22-65(45)53(74)44(24-32-19-20-33-12-5-6-13-34(33)23-32)64-50(71)42(61-51(43)72)26-36-29-55-30-58-36/h5-8,12-14,16,19-20,23,28-30,39-45,57H,3-4,9-11,15,17-18,21-22,24-27H2,1-2H3,(H2,54,68)(H,55,58)(H,56,67)(H,59,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)/t39-,40-,41-,42-,43-,44+,45-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC3R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50121268
(21-(2-Acetylamino-hexanoylamino)-7-[3-(diaminometh...)Show SMILES CCCC[C@@H](NC(C)=O)C(=O)N[C@@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O Show InChI InChI=1S/C54H71N15O9/c1-3-4-15-40(63-31(2)70)48(73)69-45-27-46(71)59-21-10-9-17-39(47(55)72)64-51(76)43(25-35-28-61-38-16-8-7-14-37(35)38)67-49(74)41(18-11-22-60-54(56)57)65-50(75)42(24-32-19-20-33-12-5-6-13-34(33)23-32)66-52(77)44(68-53(45)78)26-36-29-58-30-62-36/h5-8,12-14,16,19-20,23,28-30,39-45,61H,3-4,9-11,15,17-18,21-22,24-27H2,1-2H3,(H2,55,72)(H,58,62)(H,59,71)(H,63,70)(H,64,76)(H,65,75)(H,66,77)(H,67,74)(H,68,78)(H,69,73)(H4,56,57,60)/t39-,40+,41-,42+,43-,44-,45+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC4R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268805
(Ac-Tyr-Val-Nle-Gly-His-DPhe-trans-Xaa-Trp-Asp-Arg-...)Show SMILES CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O)N=C(N)N |r,wU:8.8,45.46,59.63,96.101,35.35,77.82,wD:4.4,57.117,12.21,63.66,85.90,(3.89,-26.77,;2.57,-27.55,;1.22,-26.79,;-.1,-27.57,;-1.45,-26.81,;-2.78,-27.6,;-2.76,-29.14,;-1.41,-29.89,;-4.09,-29.92,;-4.07,-31.46,;-5.4,-32.25,;-6.73,-31.49,;-5.38,-33.78,;-4.04,-34.54,;-2.72,-33.75,;-2.73,-32.22,;-1.4,-31.43,;-.06,-32.19,;1.27,-31.4,;-.04,-33.74,;-1.37,-34.52,;-6.71,-34.57,;-6.71,-36.11,;-8.02,-36.89,;-5.35,-36.86,;-5.43,-29.17,;-5.44,-27.63,;-6.74,-29.95,;-1.46,-25.28,;-2.8,-24.52,;-.14,-24.49,;-.16,-22.95,;1.17,-22.16,;2.52,-22.92,;1.16,-20.62,;2.48,-19.84,;2.46,-18.3,;1.13,-17.55,;.96,-16.02,;-.56,-15.71,;-1.31,-17.05,;-.27,-18.18,;3.82,-20.6,;3.85,-22.14,;5.15,-19.82,;6.5,-20.57,;6.51,-22.12,;7.85,-22.87,;7.87,-24.42,;9.21,-25.18,;10.53,-24.39,;10.51,-22.85,;9.17,-22.09,;7.86,-19.86,;9.11,-20.76,;7.93,-18.32,;6.9,-17.17,;7.69,-15.84,;9.19,-16.18,;9.34,-17.71,;10.66,-18.5,;10.65,-20.04,;12,-17.74,;13.32,-18.54,;13.31,-20.08,;14.59,-20.94,;16.03,-20.4,;16.98,-21.61,;16.14,-22.89,;16.51,-24.38,;15.41,-25.47,;13.93,-25.05,;13.55,-23.56,;14.65,-22.48,;14.67,-17.78,;14.68,-16.24,;15.99,-18.57,;17.33,-17.82,;17.34,-16.27,;18.68,-15.52,;20.02,-16.29,;18.7,-13.97,;18.66,-18.59,;18.64,-20.14,;20,-17.84,;21.32,-18.63,;21.3,-20.18,;22.62,-20.95,;22.61,-22.5,;23.94,-23.27,;23.91,-24.81,;22.59,-25.56,;25.26,-25.58,;22.66,-17.88,;22.67,-16.34,;23.99,-18.65,;25.33,-17.89,;25.35,-16.35,;26.69,-15.6,;28.02,-16.38,;29.36,-15.63,;29.38,-14.09,;28.05,-13.3,;26.71,-14.06,;26.66,-18.67,;26.64,-20.22,;28,-17.92,;29.32,-18.7,;30.66,-17.95,;31.99,-18.73,;30.68,-16.41,;7.08,-14.43,;7.99,-13.19,;7.38,-11.78,;9.52,-13.37,)| Show InChI InChI=1S/C77H102N22O16/c1-5-6-21-53(93-74(114)65(42(2)3)98-72(112)56(89-43(4)100)30-46-24-26-50(101)27-25-46)66(106)87-39-63(103)91-58(33-48-37-83-41-88-48)70(110)97-60(31-45-18-11-8-12-19-45)75(115)99-40-49(90-77(81)82)34-61(99)73(113)96-57(32-47-36-85-52-22-14-13-20-51(47)52)69(109)95-59(35-64(104)105)71(111)92-54(23-15-28-84-76(79)80)68(108)94-55(67(107)86-38-62(78)102)29-44-16-9-7-10-17-44/h7-14,16-20,22,24-27,36-37,41-42,49,53-61,65,85,101H,5-6,15,21,23,28-35,38-40H2,1-4H3,(H2,78,102)(H,83,88)(H,86,107)(H,87,106)(H,89,100)(H,91,103)(H,92,111)(H,93,114)(H,94,108)(H,95,109)(H,96,113)(H,97,110)(H,98,112)(H,104,105)(H4,79,80,84)(H4,81,82,90)/t49-,53+,54+,55+,56+,57+,58+,59+,60-,61+,65+/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | <0.100 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50268796
(Ac-Nle-c[Asp-cis-4-guanidinyl-Pro-DPhe-Arg-Trp-Lys...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,12.11,21.76,wD:25.25,39.41,61.68,63.72,(20.34,-25.22,;18.98,-24.49,;18.93,-22.95,;17.57,-22.23,;17.52,-20.69,;18.83,-19.87,;18.78,-18.33,;20.08,-17.51,;17.42,-17.6,;16.16,-19.96,;16.11,-18.42,;14.85,-20.77,;13.49,-20.05,;12.18,-20.86,;12.24,-22.4,;13.59,-23.13,;10.92,-23.22,;9.56,-22.49,;8.26,-23.31,;6.89,-22.58,;5.58,-23.39,;4.23,-22.66,;4.17,-21.12,;2.82,-20.4,;1.5,-21.21,;2.76,-18.86,;1.39,-18.12,;-.07,-18.63,;-1.33,-17.73,;-2.56,-18.65,;-2.05,-20.13,;-2.79,-21.47,;-1.99,-22.78,;-.45,-22.73,;.28,-21.39,;-.52,-20.09,;4.07,-18.04,;5.39,-18.27,;6.72,-19.07,;4.02,-16.5,;2.66,-15.78,;2.61,-14.23,;1.25,-13.51,;1.2,-11.97,;-.17,-11.24,;-.21,-9.7,;-1.47,-12.06,;5.33,-15.69,;6.69,-16.41,;6.74,-17.95,;8,-15.6,;7.95,-14.06,;6.59,-13.33,;6.54,-11.79,;5.18,-11.07,;3.87,-11.88,;3.92,-13.43,;5.27,-14.15,;9.36,-16.32,;10.67,-15.52,;10.62,-13.97,;12.04,-16.25,;13.12,-15.14,;14.62,-15.54,;14.61,-17.08,;12.07,-17.77,;13.44,-18.51,;14.75,-17.69,;15.84,-14.61,;15.64,-13.08,;14.21,-12.48,;16.87,-12.14,;2.92,-23.48,;1.55,-22.75,;2.96,-25.02,)| Show InChI InChI=1S/C50H72N16O9/c1-3-4-16-35(59-28(2)67)43(70)65-39-25-41(68)56-20-11-10-18-34(42(51)69)61-46(73)38(23-30-26-58-33-17-9-8-15-32(30)33)63-44(71)36(19-12-21-57-49(52)53)62-45(72)37(22-29-13-6-5-7-14-29)64-47(74)40-24-31(60-50(54)55)27-66(40)48(39)75/h5-9,13-15,17,26,31,34-40,58H,3-4,10-12,16,18-25,27H2,1-2H3,(H2,51,69)(H,56,68)(H,59,67)(H,61,73)(H,62,72)(H,63,71)(H,64,74)(H,65,70)(H4,52,53,57)(H4,54,55,60)/t31-,34-,35-,36-,37+,38-,39-,40-/m0/s1 | PDB
KEGG
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antibodypedia
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.70E+3 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC1R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Homo sapiens (Human)) | BDBM50268799
(Ac-Nle-c[Asp-His-DNal(2')-trans-4-guanidinyl-Pro-T...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.81,12.11,4.4,41.77,39.45,wD:61.66,25.25,(17.63,-10.54,;16.26,-9.83,;16.2,-8.29,;14.83,-7.58,;14.77,-6.04,;16.07,-5.21,;16,-3.68,;17.31,-2.85,;14.64,-2.96,;13.4,-5.33,;13.34,-3.79,;12.11,-6.15,;10.74,-5.44,;9.44,-6.27,;9.5,-7.81,;10.87,-8.52,;8.21,-8.64,;6.84,-7.92,;5.54,-8.75,;4.17,-8.03,;2.88,-8.86,;1.51,-8.15,;1.44,-6.61,;.08,-5.89,;-1.22,-6.72,;.01,-4.36,;-1.35,-3.64,;-1.42,-2.1,;-.2,-1.15,;-.74,.29,;-2.29,.23,;-3.36,1.32,;-4.84,.92,;-5.24,-.57,;-4.16,-1.64,;-2.69,-1.26,;1.32,-3.53,;1.98,-4.61,;2.31,-6.15,;2.67,-4.24,;3.31,-5.82,;4.85,-5.75,;5.26,-4.27,;3.98,-3.42,;3.91,-1.88,;2.55,-1.17,;5.21,-1.05,;5.15,.48,;3.78,1.2,;2.49,.37,;1.12,1.07,;1.05,2.62,;-.31,3.33,;-.37,4.87,;.93,5.7,;2.3,4.98,;2.36,3.44,;3.72,2.73,;6.58,-1.77,;7.88,-.94,;7.81,.6,;9.24,-1.65,;10.54,-.82,;10.49,.72,;11.7,1.66,;11.17,3.11,;9.64,3.06,;9.21,1.58,;9.31,-3.19,;10.67,-3.9,;11.98,-3.07,;5.79,-6.95,;7.3,-6.73,;8.06,-7.33,;7.86,-5.31,;.21,-8.97,;-1.16,-8.26,;.27,-10.51,)| Show InChI InChI=1S/C54H69N15O9/c1-3-4-14-40(62-30(2)70)48(73)66-43-25-46(71)59-19-10-9-16-39(47(55)72)64-49(74)41(22-34-26-60-38-15-8-7-13-37(34)38)67-52(77)45-24-36(63-54(56)57)28-69(45)53(78)44(21-31-17-18-32-11-5-6-12-33(32)20-31)68-50(75)42(65-51(43)76)23-35-27-58-29-61-35/h5-8,11-13,15,17-18,20,26-27,29,36,39-45,60H,3-4,9-10,14,16,19,21-25,28H2,1-2H3,(H2,55,72)(H,58,61)(H,59,71)(H,62,70)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,75)(H4,56,57,63)/t36-,39-,40-,41-,42-,43-,44+,45-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.40E+3 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC5R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268794
(Ac-Nle-c[Asp-His-DPhe-cis-4-guanidinyl-Pro-Trp-Lys...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H]2C[C@@H](CN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)N=C(N)N)C(N)=O |r,wU:46.49,21.76,12.11,41.72,4.4,wD:57.61,25.25,39.45,(20.33,-40.8,;18.97,-40.08,;18.92,-38.54,;17.56,-37.81,;17.51,-36.27,;18.82,-35.46,;18.77,-33.92,;20.08,-33.11,;17.41,-33.19,;16.15,-35.55,;16.1,-34.01,;14.85,-36.36,;13.49,-35.64,;12.18,-36.45,;12.23,-37.99,;13.59,-38.71,;10.92,-38.8,;9.56,-38.08,;8.26,-38.89,;6.9,-38.17,;5.59,-38.98,;4.23,-38.25,;4.18,-36.71,;2.82,-35.99,;1.52,-36.8,;2.77,-34.45,;1.41,-33.72,;1.36,-32.19,;2.59,-31.24,;2.06,-29.79,;.52,-29.85,;-.55,-28.75,;-2.04,-29.13,;-2.45,-30.61,;-1.37,-31.7,;.1,-31.32,;4.08,-33.64,;4.74,-34.72,;5.06,-36.27,;5.44,-34.36,;6.06,-35.94,;7.6,-35.89,;8.02,-34.41,;6.75,-33.55,;6.7,-32.01,;5.34,-31.28,;8,-31.2,;7.95,-29.66,;6.59,-28.93,;6.55,-27.39,;5.19,-26.67,;3.88,-27.48,;3.94,-29.03,;5.29,-29.75,;9.36,-31.92,;10.67,-31.11,;10.62,-29.57,;12.03,-31.83,;13.33,-31.02,;13.29,-29.48,;14.51,-28.54,;14,-27.09,;12.46,-27.13,;12.02,-28.61,;12.08,-33.37,;13.44,-34.1,;14.74,-33.28,;8.54,-37.11,;10.04,-36.73,;10.8,-37.54,;10.65,-35.47,;2.93,-39.07,;1.57,-38.34,;2.98,-40.61,)| Show InChI InChI=1S/C50H67N15O9/c1-3-4-15-36(58-28(2)66)44(69)62-39-23-42(67)55-18-11-10-17-35(43(51)68)60-45(70)37(20-30-24-56-34-16-9-8-14-33(30)34)63-48(73)41-22-32(59-50(52)53)26-65(41)49(74)40(19-29-12-6-5-7-13-29)64-46(71)38(61-47(39)72)21-31-25-54-27-57-31/h5-9,12-14,16,24-25,27,32,35-41,56H,3-4,10-11,15,17-23,26H2,1-2H3,(H2,51,68)(H,54,57)(H,55,67)(H,58,66)(H,60,70)(H,61,72)(H,62,69)(H,63,73)(H,64,71)(H4,52,53,59)/t32-,35-,36-,37-,38-,39-,40+,41+/m0/s1 | PDB
KEGG
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antibodypedia
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PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | n/a | n/a | 11 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC4R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50268792
(AC-Nle-c[Asp-His-DPhe-Pro-Trp-Lys]-NH2 | CHEMBL501...)Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |r| Show InChI InChI=1S/C49H64N12O9/c1-3-4-16-36(55-29(2)62)44(65)58-39-25-42(63)52-20-11-10-18-35(43(50)64)56-45(66)37(23-31-26-53-34-17-9-8-15-33(31)34)59-48(69)41-19-12-21-61(41)49(70)40(22-30-13-6-5-7-14-30)60-46(67)38(57-47(39)68)24-32-27-51-28-54-32/h5-9,13-15,17,26-28,35-41,53H,3-4,10-12,16,18-25H2,1-2H3,(H2,50,64)(H,51,54)(H,52,63)(H,55,62)(H,56,66)(H,57,68)(H,58,65)(H,59,69)(H,60,67)/t35-,36-,37-,38-,39-,40+,41-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 200 | n/a | n/a | n/a | n/a |
University of Arizona
Curated by ChEMBL
| Assay Description
Agonist activity at human MC4R expressed in HEK293 cells assessed as stimulation of intracellular cAMP level |
J Med Chem 52: 3627-35 (2009)
Article DOI: 10.1021/jm801300c
BindingDB Entry DOI: 10.7270/Q2D21ZJ5 |
More data for this
Ligand-Target Pair | |
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