Found 29 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 |
|---|
Melanocortin receptor 5
(Mus musculus (Mouse)) | BDBM50136745
(2-({2-[(2-{[2-(Acetyl-benzyl-amino)-acetyl]-benzyl...)Show SMILES CC(=O)N(CC(=O)N(CC(=O)N(CCCCNC(N)=N)CC(=O)N(CC(N)=O)Cc1cccc2ccccc12)Cc1ccccc1)Cc1ccccc1 Show InChI InChI=1S/C40H48N8O5/c1-30(49)46(23-31-13-4-2-5-14-31)28-39(53)47(24-32-15-6-3-7-16-32)29-37(51)45(22-11-10-21-44-40(42)43)27-38(52)48(26-36(41)50)25-34-19-12-18-33-17-8-9-20-35(33)34/h2-9,12-20H,10-11,21-29H2,1H3,(H2,41,50)(H4,42,43,44) | UniProtKB/SwissProt
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | n/a | n/a | 2.00E+4 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 5 receptor (MC5R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Mus musculus) | BDBM50136746
((S)-2-[(S)-2-(2-{Acetyl-[2-(1H-imidazol-4-yl)-ethy...)Show SMILES CC(=O)N(CCc1cnc[nH]1)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O Show InChI InChI=1S/C35H45N11O5/c1-22(47)46(15-13-25-19-39-21-42-25)20-31(48)43-30(16-23-8-3-2-4-9-23)34(51)44-28(12-7-14-40-35(37)38)33(50)45-29(32(36)49)17-24-18-41-27-11-6-5-10-26(24)27/h2-6,8-11,18-19,21,28-30,41H,7,12-17,20H2,1H3,(H2,36,49)(H,39,42)(H,43,48)(H,44,51)(H,45,50)(H4,37,38,40)/t28-,29-,30-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 1.70E+3 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 1 receptor (MC1R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Mus musculus) | BDBM50136745
(2-({2-[(2-{[2-(Acetyl-benzyl-amino)-acetyl]-benzyl...)Show SMILES CC(=O)N(CC(=O)N(CC(=O)N(CCCCNC(N)=N)CC(=O)N(CC(N)=O)Cc1cccc2ccccc12)Cc1ccccc1)Cc1ccccc1 Show InChI InChI=1S/C40H48N8O5/c1-30(49)46(23-31-13-4-2-5-14-31)28-39(53)47(24-32-15-6-3-7-16-32)29-37(51)45(22-11-10-21-44-40(42)43)27-38(52)48(26-36(41)50)25-34-19-12-18-33-17-8-9-20-35(33)34/h2-9,12-20H,10-11,21-29H2,1H3,(H2,41,50)(H4,42,43,44) | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | n/a | n/a | 7.60E+3 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 1 receptor (MC1R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Mus musculus) | BDBM50034922
((S)-2-{(R)-2-[(S)-2-Acetylamino-3-(1H-imidazol-4-y...)Show SMILES CC(=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(N)=O |r,wU:4.3,14.14,25.26,wD:36.37,(-8.22,-36.2,;-8.22,-37.74,;-9.55,-38.51,;-6.89,-38.5,;-5.56,-37.74,;-5.56,-36.2,;-4.23,-35.43,;-2.82,-36.06,;-1.79,-34.91,;-2.55,-33.58,;-4.06,-33.9,;-4.22,-38.5,;-4.22,-40.05,;-2.89,-37.73,;-1.56,-38.5,;-1.56,-40.04,;-.23,-40.81,;1.1,-40.05,;2.44,-40.82,;2.44,-42.35,;1.1,-43.12,;-.23,-42.35,;-.22,-37.73,;-.22,-36.19,;1.11,-38.5,;2.45,-37.74,;2.45,-36.2,;3.78,-35.43,;3.78,-33.89,;5.11,-33.12,;5.11,-31.58,;3.78,-30.82,;6.45,-30.82,;3.78,-38.51,;3.78,-40.05,;5.11,-37.73,;6.44,-38.51,;6.44,-40.05,;7.77,-40.82,;9.18,-40.2,;10.21,-41.34,;9.43,-42.67,;9.91,-44.14,;8.88,-45.29,;7.37,-44.97,;6.9,-43.5,;7.93,-42.35,;7.77,-37.74,;9.1,-38.51,;7.77,-36.2,)| Show InChI InChI=1S/C34H43N11O5/c1-20(46)42-29(16-23-18-38-19-41-23)33(50)45-28(14-21-8-3-2-4-9-21)32(49)43-26(12-7-13-39-34(36)37)31(48)44-27(30(35)47)15-22-17-40-25-11-6-5-10-24(22)25/h2-6,8-11,17-19,26-29,40H,7,12-16H2,1H3,(H2,35,47)(H,38,41)(H,42,46)(H,43,49)(H,44,48)(H,45,50)(H4,36,37,39)/t26-,27-,28+,29-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 20 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 1 receptor (MC1R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Mus musculus (Mouse)) | BDBM50136743
((S)-2-{(S)-2-[2-(Acetyl-benzyl-amino)-acetylamino]...)Show SMILES CC(=O)N(CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)Cc1ccccc1 Show InChI InChI=1S/C37H45N9O5/c1-24(47)46(22-26-13-6-3-7-14-26)23-33(48)43-32(19-25-11-4-2-5-12-25)36(51)44-30(17-10-18-41-37(39)40)35(50)45-31(34(38)49)20-27-21-42-29-16-9-8-15-28(27)29/h2-9,11-16,21,30-32,42H,10,17-20,22-23H2,1H3,(H2,38,49)(H,43,48)(H,44,51)(H,45,50)(H4,39,40,41)/t30-,31-,32-/m0/s1 | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 360 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 5 receptor (MC5R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Mus musculus (Mouse)) | BDBM50136749
(2-{{2-[{2-[(2-{Acetyl-[2-(1H-imidazol-4-yl)-ethyl]...)Show SMILES CC(=O)N(CCc1cnc[nH]1)CC(=O)N(CC(=O)N(CCCCN)CC(=O)N(CCc1c[nH]c2ccccc12)CC(N)=O)Cc1ccccc1 Show InChI InChI=1S/C36H47N9O5/c1-27(46)42(18-14-30-20-39-26-41-30)23-36(50)45(21-28-9-3-2-4-10-28)25-35(49)43(16-8-7-15-37)24-34(48)44(22-33(38)47)17-13-29-19-40-32-12-6-5-11-31(29)32/h2-6,9-12,19-20,26,40H,7-8,13-18,21-25,37H2,1H3,(H2,38,47)(H,39,41) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 7.38E+3 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 5 receptor (MC5R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Mus musculus (Mouse)) | BDBM50029747
((4S)-4-{[(1S)-1-{[(1S)-1-{[(1S)-1-{[(1S)-1-[({[(2S...)Show SMILES CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(N)=O Show InChI InChI=1S/C77H109N21O19S/c1-42(2)64(65(79)106)97-75(116)61-20-13-30-98(61)76(117)54(18-10-11-28-78)88-62(103)38-85-66(107)57(34-46-36-84-50-17-9-8-16-49(46)50)94-67(108)51(19-12-29-83-77(80)81)89-70(111)55(32-44-14-6-5-7-15-44)92-72(113)58(35-47-37-82-41-86-47)95-68(109)52(25-26-63(104)105)90-69(110)53(27-31-118-4)91-74(115)60(40-100)96-71(112)56(33-45-21-23-48(102)24-22-45)93-73(114)59(39-99)87-43(3)101/h5-9,14-17,21-24,36-37,41-42,51-61,64,84,99-100,102H,10-13,18-20,25-35,38-40,78H2,1-4H3,(H2,79,106)(H,82,86)(H,85,107)(H,87,101)(H,88,103)(H,89,111)(H,90,110)(H,91,115)(H,92,113)(H,93,114)(H,94,108)(H,95,109)(H,96,112)(H,97,116)(H,104,105)(H4,80,81,83)/t51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,64-/m0/s1 | UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 0.400 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 5 receptor (MC5R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Mus musculus) | BDBM50136748
((S)-2-{(S)-2-[(S)-2-Acetylamino-3-(1H-imidazol-4-y...)Show SMILES CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N(CCc1c[nH]c2ccccc12)CC(N)=O Show InChI InChI=1S/C35H45N11O5/c1-22(47)43-30(17-25-19-39-21-42-25)33(50)45-29(16-23-8-3-2-4-9-23)32(49)44-28(12-7-14-40-35(37)38)34(51)46(20-31(36)48)15-13-24-18-41-27-11-6-5-10-26(24)27/h2-6,8-11,18-19,21,28-30,41H,7,12-17,20H2,1H3,(H2,36,48)(H,39,42)(H,43,47)(H,44,49)(H,45,50)(H4,37,38,40)/t28-,29-,30-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 640 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 4 receptor (MC4R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Mus musculus) | BDBM50136742
((S)-2-{2-[{(S)-2-[(S)-2-Acetylamino-3-(1H-imidazol...)Show SMILES CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CCCNC(N)=N)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O Show InChI InChI=1S/C34H43N11O5/c1-21(46)42-28(16-24-18-38-20-41-24)32(49)44-29(14-22-8-3-2-4-9-22)33(50)45(13-7-12-39-34(36)37)19-30(47)43-27(31(35)48)15-23-17-40-26-11-6-5-10-25(23)26/h2-6,8-11,17-18,20,27-29,40H,7,12-16,19H2,1H3,(H2,35,48)(H,38,41)(H,42,46)(H,43,47)(H,44,49)(H4,36,37,39)/t27-,28-,29-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 9.20E+3 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 3 receptor (MC3R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Mus musculus (Mouse)) | BDBM50136746
((S)-2-[(S)-2-(2-{Acetyl-[2-(1H-imidazol-4-yl)-ethy...)Show SMILES CC(=O)N(CCc1cnc[nH]1)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O Show InChI InChI=1S/C35H45N11O5/c1-22(47)46(15-13-25-19-39-21-42-25)20-31(48)43-30(16-23-8-3-2-4-9-23)34(51)44-28(12-7-14-40-35(37)38)33(50)45-29(32(36)49)17-24-18-41-27-11-6-5-10-26(24)27/h2-6,8-11,18-19,21,28-30,41H,7,12-17,20H2,1H3,(H2,36,49)(H,39,42)(H,43,48)(H,44,51)(H,45,50)(H4,37,38,40)/t28-,29-,30-/m0/s1 | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 530 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 5 receptor (MC5R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Mus musculus) | BDBM50136748
((S)-2-{(S)-2-[(S)-2-Acetylamino-3-(1H-imidazol-4-y...)Show SMILES CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N(CCc1c[nH]c2ccccc12)CC(N)=O Show InChI InChI=1S/C35H45N11O5/c1-22(47)43-30(17-25-19-39-21-42-25)33(50)45-29(16-23-8-3-2-4-9-23)32(49)44-28(12-7-14-40-35(37)38)34(51)46(20-31(36)48)15-13-24-18-41-27-11-6-5-10-26(24)27/h2-6,8-11,18-19,21,28-30,41H,7,12-17,20H2,1H3,(H2,36,48)(H,39,42)(H,43,47)(H,44,49)(H,45,50)(H4,37,38,40)/t28-,29-,30-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 500 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 1 receptor (MC1R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Mus musculus) | BDBM50029747
((4S)-4-{[(1S)-1-{[(1S)-1-{[(1S)-1-{[(1S)-1-[({[(2S...)Show SMILES CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(N)=O Show InChI InChI=1S/C77H109N21O19S/c1-42(2)64(65(79)106)97-75(116)61-20-13-30-98(61)76(117)54(18-10-11-28-78)88-62(103)38-85-66(107)57(34-46-36-84-50-17-9-8-16-49(46)50)94-67(108)51(19-12-29-83-77(80)81)89-70(111)55(32-44-14-6-5-7-15-44)92-72(113)58(35-47-37-82-41-86-47)95-68(109)52(25-26-63(104)105)90-69(110)53(27-31-118-4)91-74(115)60(40-100)96-71(112)56(33-45-21-23-48(102)24-22-45)93-73(114)59(39-99)87-43(3)101/h5-9,14-17,21-24,36-37,41-42,51-61,64,84,99-100,102H,10-13,18-20,25-35,38-40,78H2,1-4H3,(H2,79,106)(H,82,86)(H,85,107)(H,87,101)(H,88,103)(H,89,111)(H,90,110)(H,91,115)(H,92,113)(H,93,114)(H,94,108)(H,95,109)(H,96,112)(H,97,116)(H,104,105)(H4,80,81,83)/t51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,64-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 5.40 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 4 receptor (MC4R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Mus musculus) | BDBM50136747
((S)-2-(2-{[(S)-2-Acetylamino-3-(1H-imidazol-4-yl)-...)Show SMILES CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N(CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)Cc1ccccc1 Show InChI InChI=1S/C34H43N11O5/c1-21(46)42-29(15-24-17-38-20-41-24)33(50)45(18-22-8-3-2-4-9-22)19-30(47)43-27(12-7-13-39-34(36)37)32(49)44-28(31(35)48)14-23-16-40-26-11-6-5-10-25(23)26/h2-6,8-11,16-17,20,27-29,40H,7,12-15,18-19H2,1H3,(H2,35,48)(H,38,41)(H,42,46)(H,43,47)(H,44,49)(H4,36,37,39)/t27-,28-,29-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 4.80E+4 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 1 receptor (MC1R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Mus musculus) | BDBM50034922
((S)-2-{(R)-2-[(S)-2-Acetylamino-3-(1H-imidazol-4-y...)Show SMILES CC(=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(N)=O |r,wU:4.3,14.14,25.26,wD:36.37,(-8.22,-36.2,;-8.22,-37.74,;-9.55,-38.51,;-6.89,-38.5,;-5.56,-37.74,;-5.56,-36.2,;-4.23,-35.43,;-2.82,-36.06,;-1.79,-34.91,;-2.55,-33.58,;-4.06,-33.9,;-4.22,-38.5,;-4.22,-40.05,;-2.89,-37.73,;-1.56,-38.5,;-1.56,-40.04,;-.23,-40.81,;1.1,-40.05,;2.44,-40.82,;2.44,-42.35,;1.1,-43.12,;-.23,-42.35,;-.22,-37.73,;-.22,-36.19,;1.11,-38.5,;2.45,-37.74,;2.45,-36.2,;3.78,-35.43,;3.78,-33.89,;5.11,-33.12,;5.11,-31.58,;3.78,-30.82,;6.45,-30.82,;3.78,-38.51,;3.78,-40.05,;5.11,-37.73,;6.44,-38.51,;6.44,-40.05,;7.77,-40.82,;9.18,-40.2,;10.21,-41.34,;9.43,-42.67,;9.91,-44.14,;8.88,-45.29,;7.37,-44.97,;6.9,-43.5,;7.93,-42.35,;7.77,-37.74,;9.1,-38.51,;7.77,-36.2,)| Show InChI InChI=1S/C34H43N11O5/c1-20(46)42-29(16-23-18-38-19-41-23)33(50)45-28(14-21-8-3-2-4-9-21)32(49)43-26(12-7-13-39-34(36)37)31(48)44-27(30(35)47)15-22-17-40-25-11-6-5-10-24(22)25/h2-6,8-11,17-19,26-29,40H,7,12-16H2,1H3,(H2,35,47)(H,38,41)(H,42,46)(H,43,49)(H,44,48)(H,45,50)(H4,36,37,39)/t26-,27-,28+,29-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 160 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 3 receptor (MC3R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Mus musculus) | BDBM50136746
((S)-2-[(S)-2-(2-{Acetyl-[2-(1H-imidazol-4-yl)-ethy...)Show SMILES CC(=O)N(CCc1cnc[nH]1)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O Show InChI InChI=1S/C35H45N11O5/c1-22(47)46(15-13-25-19-39-21-42-25)20-31(48)43-30(16-23-8-3-2-4-9-23)34(51)44-28(12-7-14-40-35(37)38)33(50)45-29(32(36)49)17-24-18-41-27-11-6-5-10-26(24)27/h2-6,8-11,18-19,21,28-30,41H,7,12-17,20H2,1H3,(H2,36,49)(H,39,42)(H,43,48)(H,44,51)(H,45,50)(H4,37,38,40)/t28-,29-,30-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 880 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 4 receptor (MC4R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Mus musculus) | BDBM50136749
(2-{{2-[{2-[(2-{Acetyl-[2-(1H-imidazol-4-yl)-ethyl]...)Show SMILES CC(=O)N(CCc1cnc[nH]1)CC(=O)N(CC(=O)N(CCCCN)CC(=O)N(CCc1c[nH]c2ccccc12)CC(N)=O)Cc1ccccc1 Show InChI InChI=1S/C36H47N9O5/c1-27(46)42(18-14-30-20-39-26-41-30)23-36(50)45(21-28-9-3-2-4-10-28)25-35(49)43(16-8-7-15-37)24-34(48)44(22-33(38)47)17-13-29-19-40-32-12-6-5-11-31(29)32/h2-6,9-12,19-20,26,40H,7-8,13-18,21-25,37H2,1H3,(H2,38,47)(H,39,41) | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 2.70E+4 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 1 receptor (MC1R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Mus musculus) | BDBM50136742
((S)-2-{2-[{(S)-2-[(S)-2-Acetylamino-3-(1H-imidazol...)Show SMILES CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CCCNC(N)=N)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O Show InChI InChI=1S/C34H43N11O5/c1-21(46)42-28(16-24-18-38-20-41-24)32(49)44-29(14-22-8-3-2-4-9-22)33(50)45(13-7-12-39-34(36)37)19-30(47)43-27(31(35)48)15-23-17-40-26-11-6-5-10-25(23)26/h2-6,8-11,17-18,20,27-29,40H,7,12-16,19H2,1H3,(H2,35,48)(H,38,41)(H,42,46)(H,43,47)(H,44,49)(H4,36,37,39)/t27-,28-,29-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 170 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 1 receptor (MC1R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Mus musculus) | BDBM50136742
((S)-2-{2-[{(S)-2-[(S)-2-Acetylamino-3-(1H-imidazol...)Show SMILES CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CCCNC(N)=N)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O Show InChI InChI=1S/C34H43N11O5/c1-21(46)42-28(16-24-18-38-20-41-24)32(49)44-29(14-22-8-3-2-4-9-22)33(50)45(13-7-12-39-34(36)37)19-30(47)43-27(31(35)48)15-23-17-40-26-11-6-5-10-25(23)26/h2-6,8-11,17-18,20,27-29,40H,7,12-16,19H2,1H3,(H2,35,48)(H,38,41)(H,42,46)(H,43,47)(H,44,49)(H4,36,37,39)/t27-,28-,29-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 1.10E+3 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 4 receptor (MC4R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Mus musculus (Mouse)) | BDBM50136742
((S)-2-{2-[{(S)-2-[(S)-2-Acetylamino-3-(1H-imidazol...)Show SMILES CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CCCNC(N)=N)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O Show InChI InChI=1S/C34H43N11O5/c1-21(46)42-28(16-24-18-38-20-41-24)32(49)44-29(14-22-8-3-2-4-9-22)33(50)45(13-7-12-39-34(36)37)19-30(47)43-27(31(35)48)15-23-17-40-26-11-6-5-10-25(23)26/h2-6,8-11,17-18,20,27-29,40H,7,12-16,19H2,1H3,(H2,35,48)(H,38,41)(H,42,46)(H,43,47)(H,44,49)(H4,36,37,39)/t27-,28-,29-/m0/s1 | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 160 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 5 receptor (MC5R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Mus musculus) | BDBM50029747
((4S)-4-{[(1S)-1-{[(1S)-1-{[(1S)-1-{[(1S)-1-[({[(2S...)Show SMILES CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(N)=O Show InChI InChI=1S/C77H109N21O19S/c1-42(2)64(65(79)106)97-75(116)61-20-13-30-98(61)76(117)54(18-10-11-28-78)88-62(103)38-85-66(107)57(34-46-36-84-50-17-9-8-16-49(46)50)94-67(108)51(19-12-29-83-77(80)81)89-70(111)55(32-44-14-6-5-7-15-44)92-72(113)58(35-47-37-82-41-86-47)95-68(109)52(25-26-63(104)105)90-69(110)53(27-31-118-4)91-74(115)60(40-100)96-71(112)56(33-45-21-23-48(102)24-22-45)93-73(114)59(39-99)87-43(3)101/h5-9,14-17,21-24,36-37,41-42,51-61,64,84,99-100,102H,10-13,18-20,25-35,38-40,78H2,1-4H3,(H2,79,106)(H,82,86)(H,85,107)(H,87,101)(H,88,103)(H,89,111)(H,90,110)(H,91,115)(H,92,113)(H,93,114)(H,94,108)(H,95,109)(H,96,112)(H,97,116)(H,104,105)(H4,80,81,83)/t51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,64-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
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| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 0.800 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 3 receptor (MC3R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Mus musculus) | BDBM50029747
((4S)-4-{[(1S)-1-{[(1S)-1-{[(1S)-1-{[(1S)-1-[({[(2S...)Show SMILES CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(N)=O Show InChI InChI=1S/C77H109N21O19S/c1-42(2)64(65(79)106)97-75(116)61-20-13-30-98(61)76(117)54(18-10-11-28-78)88-62(103)38-85-66(107)57(34-46-36-84-50-17-9-8-16-49(46)50)94-67(108)51(19-12-29-83-77(80)81)89-70(111)55(32-44-14-6-5-7-15-44)92-72(113)58(35-47-37-82-41-86-47)95-68(109)52(25-26-63(104)105)90-69(110)53(27-31-118-4)91-74(115)60(40-100)96-71(112)56(33-45-21-23-48(102)24-22-45)93-73(114)59(39-99)87-43(3)101/h5-9,14-17,21-24,36-37,41-42,51-61,64,84,99-100,102H,10-13,18-20,25-35,38-40,78H2,1-4H3,(H2,79,106)(H,82,86)(H,85,107)(H,87,101)(H,88,103)(H,89,111)(H,90,110)(H,91,115)(H,92,113)(H,93,114)(H,94,108)(H,95,109)(H,96,112)(H,97,116)(H,104,105)(H4,80,81,83)/t51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,64-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 0.600 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 1 receptor (MC1R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Mus musculus) | BDBM50136749
(2-{{2-[{2-[(2-{Acetyl-[2-(1H-imidazol-4-yl)-ethyl]...)Show SMILES CC(=O)N(CCc1cnc[nH]1)CC(=O)N(CC(=O)N(CCCCN)CC(=O)N(CCc1c[nH]c2ccccc12)CC(N)=O)Cc1ccccc1 Show InChI InChI=1S/C36H47N9O5/c1-27(46)42(18-14-30-20-39-26-41-30)23-36(50)45(21-28-9-3-2-4-10-28)25-35(49)43(16-8-7-15-37)24-34(48)44(22-33(38)47)17-13-29-19-40-32-12-6-5-11-31(29)32/h2-6,9-12,19-20,26,40H,7-8,13-18,21-25,37H2,1H3,(H2,38,47)(H,39,41) | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 2.72E+4 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 4 receptor (MC4R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Mus musculus) | BDBM50136743
((S)-2-{(S)-2-[2-(Acetyl-benzyl-amino)-acetylamino]...)Show SMILES CC(=O)N(CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)Cc1ccccc1 Show InChI InChI=1S/C37H45N9O5/c1-24(47)46(22-26-13-6-3-7-14-26)23-33(48)43-32(19-25-11-4-2-5-12-25)36(51)44-30(17-10-18-41-37(39)40)35(50)45-31(34(38)49)20-27-21-42-29-16-9-8-15-28(27)29/h2-9,11-16,21,30-32,42H,10,17-20,22-23H2,1H3,(H2,38,49)(H,43,48)(H,44,51)(H,45,50)(H4,39,40,41)/t30-,31-,32-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 780 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 1 receptor (MC1R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Mus musculus (Mouse)) | BDBM50136750
(2-{{2-[{2-[(2-{Acetyl-[2-(1H-imidazol-4-yl)-ethyl]...)Show SMILES CC(=O)N(CCc1cnc[nH]1)CC(=O)N(CC(=O)N(CCCNC(N)=N)CC(=O)N(CCc1c[nH]c2ccccc12)CC(N)=O)Cc1ccccc1 Show InChI InChI=1S/C36H47N11O5/c1-26(48)44(17-13-29-19-40-25-43-29)22-35(52)47(20-27-8-3-2-4-9-27)24-34(51)45(15-7-14-41-36(38)39)23-33(50)46(21-32(37)49)16-12-28-18-42-31-11-6-5-10-30(28)31/h2-6,8-11,18-19,25,42H,7,12-17,20-24H2,1H3,(H2,37,49)(H,40,43)(H4,38,39,41) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 5.30E+3 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 5 receptor (MC5R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Mus musculus) | BDBM50136743
((S)-2-{(S)-2-[2-(Acetyl-benzyl-amino)-acetylamino]...)Show SMILES CC(=O)N(CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)Cc1ccccc1 Show InChI InChI=1S/C37H45N9O5/c1-24(47)46(22-26-13-6-3-7-14-26)23-33(48)43-32(19-25-11-4-2-5-12-25)36(51)44-30(17-10-18-41-37(39)40)35(50)45-31(34(38)49)20-27-21-42-29-16-9-8-15-28(27)29/h2-9,11-16,21,30-32,42H,10,17-20,22-23H2,1H3,(H2,38,49)(H,43,48)(H,44,51)(H,45,50)(H4,39,40,41)/t30-,31-,32-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 260 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 4 receptor (MC4R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Mus musculus (Mouse)) | BDBM50034922
((S)-2-{(R)-2-[(S)-2-Acetylamino-3-(1H-imidazol-4-y...)Show SMILES CC(=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(N)=O |r,wU:4.3,14.14,25.26,wD:36.37,(-8.22,-36.2,;-8.22,-37.74,;-9.55,-38.51,;-6.89,-38.5,;-5.56,-37.74,;-5.56,-36.2,;-4.23,-35.43,;-2.82,-36.06,;-1.79,-34.91,;-2.55,-33.58,;-4.06,-33.9,;-4.22,-38.5,;-4.22,-40.05,;-2.89,-37.73,;-1.56,-38.5,;-1.56,-40.04,;-.23,-40.81,;1.1,-40.05,;2.44,-40.82,;2.44,-42.35,;1.1,-43.12,;-.23,-42.35,;-.22,-37.73,;-.22,-36.19,;1.11,-38.5,;2.45,-37.74,;2.45,-36.2,;3.78,-35.43,;3.78,-33.89,;5.11,-33.12,;5.11,-31.58,;3.78,-30.82,;6.45,-30.82,;3.78,-38.51,;3.78,-40.05,;5.11,-37.73,;6.44,-38.51,;6.44,-40.05,;7.77,-40.82,;9.18,-40.2,;10.21,-41.34,;9.43,-42.67,;9.91,-44.14,;8.88,-45.29,;7.37,-44.97,;6.9,-43.5,;7.93,-42.35,;7.77,-37.74,;9.1,-38.51,;7.77,-36.2,)| Show InChI InChI=1S/C34H43N11O5/c1-20(46)42-29(16-23-18-38-19-41-23)33(50)45-28(14-21-8-3-2-4-9-21)32(49)43-26(12-7-13-39-34(36)37)31(48)44-27(30(35)47)15-22-17-40-25-11-6-5-10-24(22)25/h2-6,8-11,17-19,26-29,40H,7,12-16H2,1H3,(H2,35,47)(H,38,41)(H,42,46)(H,43,49)(H,44,48)(H,45,50)(H4,36,37,39)/t26-,27-,28+,29-/m0/s1 | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 4 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 5 receptor (MC5R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Mus musculus) | BDBM50136750
(2-{{2-[{2-[(2-{Acetyl-[2-(1H-imidazol-4-yl)-ethyl]...)Show SMILES CC(=O)N(CCc1cnc[nH]1)CC(=O)N(CC(=O)N(CCCNC(N)=N)CC(=O)N(CCc1c[nH]c2ccccc12)CC(N)=O)Cc1ccccc1 Show InChI InChI=1S/C36H47N11O5/c1-26(48)44(17-13-29-19-40-25-43-29)22-35(52)47(20-27-8-3-2-4-9-27)24-34(51)45(15-7-14-41-36(38)39)23-33(50)46(21-32(37)49)16-12-28-18-42-31-11-6-5-10-30(28)31/h2-6,8-11,18-19,25,42H,7,12-17,20-24H2,1H3,(H2,37,49)(H,40,43)(H4,38,39,41) | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 6.60E+3 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 1 receptor (MC1R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Mus musculus) | BDBM50034922
((S)-2-{(R)-2-[(S)-2-Acetylamino-3-(1H-imidazol-4-y...)Show SMILES CC(=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(N)=O |r,wU:4.3,14.14,25.26,wD:36.37,(-8.22,-36.2,;-8.22,-37.74,;-9.55,-38.51,;-6.89,-38.5,;-5.56,-37.74,;-5.56,-36.2,;-4.23,-35.43,;-2.82,-36.06,;-1.79,-34.91,;-2.55,-33.58,;-4.06,-33.9,;-4.22,-38.5,;-4.22,-40.05,;-2.89,-37.73,;-1.56,-38.5,;-1.56,-40.04,;-.23,-40.81,;1.1,-40.05,;2.44,-40.82,;2.44,-42.35,;1.1,-43.12,;-.23,-42.35,;-.22,-37.73,;-.22,-36.19,;1.11,-38.5,;2.45,-37.74,;2.45,-36.2,;3.78,-35.43,;3.78,-33.89,;5.11,-33.12,;5.11,-31.58,;3.78,-30.82,;6.45,-30.82,;3.78,-38.51,;3.78,-40.05,;5.11,-37.73,;6.44,-38.51,;6.44,-40.05,;7.77,-40.82,;9.18,-40.2,;10.21,-41.34,;9.43,-42.67,;9.91,-44.14,;8.88,-45.29,;7.37,-44.97,;6.9,-43.5,;7.93,-42.35,;7.77,-37.74,;9.1,-38.51,;7.77,-36.2,)| Show InChI InChI=1S/C34H43N11O5/c1-20(46)42-29(16-23-18-38-19-41-23)33(50)45-28(14-21-8-3-2-4-9-21)32(49)43-26(12-7-13-39-34(36)37)31(48)44-27(30(35)47)15-22-17-40-25-11-6-5-10-24(22)25/h2-6,8-11,17-19,26-29,40H,7,12-16H2,1H3,(H2,35,47)(H,38,41)(H,42,46)(H,43,49)(H,44,48)(H,45,50)(H4,36,37,39)/t26-,27-,28+,29-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 17 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 4 receptor (MC4R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5
(Mus musculus (Mouse)) | BDBM50136748
((S)-2-{(S)-2-[(S)-2-Acetylamino-3-(1H-imidazol-4-y...)Show SMILES CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N(CCc1c[nH]c2ccccc12)CC(N)=O Show InChI InChI=1S/C35H45N11O5/c1-22(47)43-30(17-25-19-39-21-42-25)33(50)45-29(16-23-8-3-2-4-9-23)32(49)44-28(12-7-14-40-35(37)38)34(51)46(20-31(36)48)15-13-24-18-41-27-11-6-5-10-26(24)27/h2-6,8-11,18-19,21,28-30,41H,7,12-17,20H2,1H3,(H2,36,48)(H,39,42)(H,43,47)(H,44,49)(H,45,50)(H4,37,38,40)/t28-,29-,30-/m0/s1 | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 56 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonistic activity evaluated at melanocortin 5 receptor (MC5R) of mouse HEK293 cells |
Bioorg Med Chem Lett 13: 4505-9 (2003)
BindingDB Entry DOI: 10.7270/Q2N29XHH |
More data for this
Ligand-Target Pair | |
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