Found 21 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 4
(Homo sapiens (Human)) | BDBM50130009
((4S,15R,18S,21S,24S)-5-((S)-2-Acetylamino-hexanoyl...)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](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C1=O)C(N)=O Show InChI InChI=1S/C49H69N13O9/c1-3-4-17-35(56-29(2)63)43(66)61-39-27-41(64)53-22-11-10-19-34(42(50)65)57-46(69)38(26-31-28-55-33-18-9-8-16-32(31)33)59-44(67)36(20-12-23-54-49(51)52)58-45(68)37(25-30-14-6-5-7-15-30)60-47(70)40-21-13-24-62(40)48(39)71/h5-9,14-16,18,28,34-40,55H,3-4,10-13,17,19-27H2,1-2H3,(H2,50,65)(H,53,64)(H,56,63)(H,57,69)(H,58,68)(H,59,67)(H,60,70)(H,61,66)(H4,51,52,54)/t34-,35+,36+,37+,38-,39+,40+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity towards human melanocortin 4 receptor (hMC4R) using [125I]NDP-alpha-MSH as radioligand |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50130014
((R)-2-Acetylamino-N-(4-{acetyl-[2-(1H-indol-3-yl)-...)Show SMILES CC(=O)N[C@H](Cc1ccccc1)C(=O)N(CCCCNC(N)=N)C1CCC(CC1)N(CCc1c[nH]c2ccccc12)C(C)=O |wD:4.3,(14.52,1.42,;13.19,.63,;13.2,-.91,;11.84,1.39,;10.51,.61,;10.53,-.94,;11.29,-2.27,;12.81,-2.27,;13.57,-3.59,;12.8,-4.92,;11.27,-4.91,;10.51,-3.59,;9.17,1.37,;9.15,2.91,;7.84,.58,;6.5,1.35,;6.48,2.89,;5.14,3.64,;5.13,5.18,;3.77,5.94,;2.46,5.16,;1.11,5.93,;2.46,3.62,;7.86,-.97,;7.09,-2.32,;5.36,-1.71,;4.19,-2.13,;4.94,-.77,;6.58,-1.39,;2.85,-1.36,;1.52,-2.13,;1.5,-3.67,;.17,-4.43,;-1.24,-3.8,;-2.28,-4.94,;-1.51,-6.27,;-1.99,-7.72,;-.97,-8.88,;.55,-8.57,;1.01,-7.11,;,-5.97,;2.85,.19,;1.52,.96,;4.19,.96,)| Show InChI InChI=1S/C34H47N7O3/c1-24(42)39-32(22-26-10-4-3-5-11-26)33(44)41(20-9-8-19-37-34(35)36)29-16-14-28(15-17-29)40(25(2)43)21-18-27-23-38-31-13-7-6-12-30(27)31/h3-7,10-13,23,28-29,32,38H,8-9,14-22H2,1-2H3,(H,39,42)(H4,35,36,37)/t28?,29?,32-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 7.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity towards human melanocortin 4 receptor (hMC4R) using [125I]NDP-alpha-MSH as radioligand |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50130009
((4S,15R,18S,21S,24S)-5-((S)-2-Acetylamino-hexanoyl...)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](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C1=O)C(N)=O Show InChI InChI=1S/C49H69N13O9/c1-3-4-17-35(56-29(2)63)43(66)61-39-27-41(64)53-22-11-10-19-34(42(50)65)57-46(69)38(26-31-28-55-33-18-9-8-16-32(31)33)59-44(67)36(20-12-23-54-49(51)52)58-45(68)37(25-30-14-6-5-7-15-30)60-47(70)40-21-13-24-62(40)48(39)71/h5-9,14-16,18,28,34-40,55H,3-4,10-13,17,19-27H2,1-2H3,(H2,50,65)(H,53,64)(H,56,63)(H,57,69)(H,58,68)(H,59,67)(H,60,70)(H,61,66)(H4,51,52,54)/t34-,35+,36+,37+,38-,39+,40+/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 23 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity towards human melanocortin 3 receptor (hMC3R) using [125I]NDP-alpha-MSH as radioligand |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Mus musculus) | BDBM50130014
((R)-2-Acetylamino-N-(4-{acetyl-[2-(1H-indol-3-yl)-...)Show SMILES CC(=O)N[C@H](Cc1ccccc1)C(=O)N(CCCCNC(N)=N)C1CCC(CC1)N(CCc1c[nH]c2ccccc12)C(C)=O |wD:4.3,(14.52,1.42,;13.19,.63,;13.2,-.91,;11.84,1.39,;10.51,.61,;10.53,-.94,;11.29,-2.27,;12.81,-2.27,;13.57,-3.59,;12.8,-4.92,;11.27,-4.91,;10.51,-3.59,;9.17,1.37,;9.15,2.91,;7.84,.58,;6.5,1.35,;6.48,2.89,;5.14,3.64,;5.13,5.18,;3.77,5.94,;2.46,5.16,;1.11,5.93,;2.46,3.62,;7.86,-.97,;7.09,-2.32,;5.36,-1.71,;4.19,-2.13,;4.94,-.77,;6.58,-1.39,;2.85,-1.36,;1.52,-2.13,;1.5,-3.67,;.17,-4.43,;-1.24,-3.8,;-2.28,-4.94,;-1.51,-6.27,;-1.99,-7.72,;-.97,-8.88,;.55,-8.57,;1.01,-7.11,;,-5.97,;2.85,.19,;1.52,.96,;4.19,.96,)| Show InChI InChI=1S/C34H47N7O3/c1-24(42)39-32(22-26-10-4-3-5-11-26)33(44)41(20-9-8-19-37-34(35)36)29-16-14-28(15-17-29)40(25(2)43)21-18-27-23-38-31-13-7-6-12-30(27)31/h3-7,10-13,23,28-29,32,38H,8-9,14-22H2,1-2H3,(H,39,42)(H4,35,36,37)/t28?,29?,32-/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 51 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity towards mouse Melanocortin 1 receptor (mMC1R) using [125I]NDP-alpha-MSH as radioligand |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50130014
((R)-2-Acetylamino-N-(4-{acetyl-[2-(1H-indol-3-yl)-...)Show SMILES CC(=O)N[C@H](Cc1ccccc1)C(=O)N(CCCCNC(N)=N)C1CCC(CC1)N(CCc1c[nH]c2ccccc12)C(C)=O |wD:4.3,(14.52,1.42,;13.19,.63,;13.2,-.91,;11.84,1.39,;10.51,.61,;10.53,-.94,;11.29,-2.27,;12.81,-2.27,;13.57,-3.59,;12.8,-4.92,;11.27,-4.91,;10.51,-3.59,;9.17,1.37,;9.15,2.91,;7.84,.58,;6.5,1.35,;6.48,2.89,;5.14,3.64,;5.13,5.18,;3.77,5.94,;2.46,5.16,;1.11,5.93,;2.46,3.62,;7.86,-.97,;7.09,-2.32,;5.36,-1.71,;4.19,-2.13,;4.94,-.77,;6.58,-1.39,;2.85,-1.36,;1.52,-2.13,;1.5,-3.67,;.17,-4.43,;-1.24,-3.8,;-2.28,-4.94,;-1.51,-6.27,;-1.99,-7.72,;-.97,-8.88,;.55,-8.57,;1.01,-7.11,;,-5.97,;2.85,.19,;1.52,.96,;4.19,.96,)| Show InChI InChI=1S/C34H47N7O3/c1-24(42)39-32(22-26-10-4-3-5-11-26)33(44)41(20-9-8-19-37-34(35)36)29-16-14-28(15-17-29)40(25(2)43)21-18-27-23-38-31-13-7-6-12-30(27)31/h3-7,10-13,23,28-29,32,38H,8-9,14-22H2,1-2H3,(H,39,42)(H4,35,36,37)/t28?,29?,32-/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity towards human melanocortin 3 receptor (hMC3R) using [125I]NDP-alpha-MSH as radioligand |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50130014
((R)-2-Acetylamino-N-(4-{acetyl-[2-(1H-indol-3-yl)-...)Show SMILES CC(=O)N[C@H](Cc1ccccc1)C(=O)N(CCCCNC(N)=N)C1CCC(CC1)N(CCc1c[nH]c2ccccc12)C(C)=O |wD:4.3,(14.52,1.42,;13.19,.63,;13.2,-.91,;11.84,1.39,;10.51,.61,;10.53,-.94,;11.29,-2.27,;12.81,-2.27,;13.57,-3.59,;12.8,-4.92,;11.27,-4.91,;10.51,-3.59,;9.17,1.37,;9.15,2.91,;7.84,.58,;6.5,1.35,;6.48,2.89,;5.14,3.64,;5.13,5.18,;3.77,5.94,;2.46,5.16,;1.11,5.93,;2.46,3.62,;7.86,-.97,;7.09,-2.32,;5.36,-1.71,;4.19,-2.13,;4.94,-.77,;6.58,-1.39,;2.85,-1.36,;1.52,-2.13,;1.5,-3.67,;.17,-4.43,;-1.24,-3.8,;-2.28,-4.94,;-1.51,-6.27,;-1.99,-7.72,;-.97,-8.88,;.55,-8.57,;1.01,-7.11,;,-5.97,;2.85,.19,;1.52,.96,;4.19,.96,)| Show InChI InChI=1S/C34H47N7O3/c1-24(42)39-32(22-26-10-4-3-5-11-26)33(44)41(20-9-8-19-37-34(35)36)29-16-14-28(15-17-29)40(25(2)43)21-18-27-23-38-31-13-7-6-12-30(27)31/h3-7,10-13,23,28-29,32,38H,8-9,14-22H2,1-2H3,(H,39,42)(H4,35,36,37)/t28?,29?,32-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Intracellular levels of cAMP in HEK 293 cells expressing human melanocortin 4 receptor (hMC4R) |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50130014
((R)-2-Acetylamino-N-(4-{acetyl-[2-(1H-indol-3-yl)-...)Show SMILES CC(=O)N[C@H](Cc1ccccc1)C(=O)N(CCCCNC(N)=N)C1CCC(CC1)N(CCc1c[nH]c2ccccc12)C(C)=O |wD:4.3,(14.52,1.42,;13.19,.63,;13.2,-.91,;11.84,1.39,;10.51,.61,;10.53,-.94,;11.29,-2.27,;12.81,-2.27,;13.57,-3.59,;12.8,-4.92,;11.27,-4.91,;10.51,-3.59,;9.17,1.37,;9.15,2.91,;7.84,.58,;6.5,1.35,;6.48,2.89,;5.14,3.64,;5.13,5.18,;3.77,5.94,;2.46,5.16,;1.11,5.93,;2.46,3.62,;7.86,-.97,;7.09,-2.32,;5.36,-1.71,;4.19,-2.13,;4.94,-.77,;6.58,-1.39,;2.85,-1.36,;1.52,-2.13,;1.5,-3.67,;.17,-4.43,;-1.24,-3.8,;-2.28,-4.94,;-1.51,-6.27,;-1.99,-7.72,;-.97,-8.88,;.55,-8.57,;1.01,-7.11,;,-5.97,;2.85,.19,;1.52,.96,;4.19,.96,)| Show InChI InChI=1S/C34H47N7O3/c1-24(42)39-32(22-26-10-4-3-5-11-26)33(44)41(20-9-8-19-37-34(35)36)29-16-14-28(15-17-29)40(25(2)43)21-18-27-23-38-31-13-7-6-12-30(27)31/h3-7,10-13,23,28-29,32,38H,8-9,14-22H2,1-2H3,(H,39,42)(H4,35,36,37)/t28?,29?,32-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Intracellular levels of cAMP in HEK 293 cells expressing human melanocortin 4 receptor (hMC4R) |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Mus musculus) | BDBM50130013
((S)-2-Acetylamino-N-[4-(acetyl-methyl-amino)-cyclo...)Show SMILES CN(C1CCC(CC1)N(CCCCNC(N)=N)C(=O)[C@H](Cc1ccccc1)NC(C)=O)C(C)=O |wU:19.28,(-1.99,-5.9,;-.65,-5.13,;.68,-5.9,;1.43,-4.54,;3.07,-5.18,;4.33,-4.75,;3.59,-6.1,;1.86,-5.48,;4.33,-3.2,;2.99,-2.44,;2.98,-.9,;1.64,-.14,;1.62,1.4,;.27,2.17,;-1.05,1.38,;-2.4,2.14,;-1.04,-.16,;5.67,-2.42,;5.64,-.87,;7,-3.16,;7.02,-4.71,;7.79,-6.04,;9.31,-6.04,;10.06,-7.37,;9.29,-8.7,;7.76,-8.68,;7,-7.37,;8.33,-2.38,;9.68,-3.14,;11.01,-2.36,;9.69,-4.68,;-.65,-3.59,;-1.99,-2.81,;.68,-2.81,)| Show InChI InChI=1S/C25H40N6O3/c1-18(32)29-23(17-20-9-5-4-6-10-20)24(34)31(16-8-7-15-28-25(26)27)22-13-11-21(12-14-22)30(3)19(2)33/h4-6,9-10,21-23H,7-8,11-17H2,1-3H3,(H,29,32)(H4,26,27,28)/t21?,22?,23-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 9.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity towards mouse Melanocortin 1 receptor (mMC1R) using [125I]NDP-alpha-MSH as radioligand |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50130011
((S)-2-Acetylamino-N-(4-{acetyl-[2-(1H-indol-3-yl)-...)Show SMILES CC(=O)N[C@@H](Cc1ccccc1)C(=O)N(CCCCN)C1CCC(CC1)N(CCc1c[nH]c2ccccc12)C(C)=O |wU:4.3,(14.76,-.51,;13.43,-1.29,;13.44,-2.84,;12.09,-.54,;10.76,-1.32,;10.76,-2.86,;11.54,-4.19,;10.76,-5.52,;11.51,-6.84,;13.03,-6.85,;13.8,-5.53,;13.05,-4.19,;9.41,-.57,;9.4,.97,;8.09,-1.36,;6.74,-.59,;6.72,.95,;5.39,1.71,;5.36,3.25,;4.02,4.01,;8.1,-2.91,;7.33,-4.26,;5.61,-3.63,;4.43,-4.05,;5.19,-2.7,;6.83,-3.33,;3.09,-3.28,;1.76,-4.05,;1.75,-5.6,;.41,-6.37,;-1,-5.73,;-2.03,-6.87,;-1.26,-8.21,;-1.75,-9.66,;-.72,-10.81,;.78,-10.5,;1.26,-9.03,;.24,-7.9,;3.09,-1.74,;1.76,-.97,;4.43,-.97,)| Show InChI InChI=1S/C33H45N5O3/c1-24(39)36-32(22-26-10-4-3-5-11-26)33(41)38(20-9-8-19-34)29-16-14-28(15-17-29)37(25(2)40)21-18-27-23-35-31-13-7-6-12-30(27)31/h3-7,10-13,23,28-29,32,35H,8-9,14-22,34H2,1-2H3,(H,36,39)/t28?,29?,32-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 9.25E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity towards human melanocortin 4 receptor (hMC4R) using [125I]NDP-alpha-MSH as radioligand |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50130012
(CHEMBL75185 | N-{4-[Acetyl-(4-guanidino-butyl)-ami...)Show SMILES CC(=O)N(CCCCNC(N)=N)C1CCC(CC1)N(CCc1c[nH]c2ccccc12)C(C)=O |(14.36,-.97,;13.01,-.22,;13,1.32,;11.7,-1,;10.35,-.24,;10.33,1.3,;9,2.05,;8.97,3.6,;7.63,4.36,;6.31,3.57,;4.96,4.33,;6.33,2.03,;11.7,-2.55,;10.93,-3.9,;9.22,-3.28,;8.04,-3.7,;8.8,-2.34,;10.44,-2.97,;6.71,-2.93,;5.38,-3.7,;5.37,-5.24,;4.02,-6.01,;2.62,-5.37,;1.59,-6.51,;2.36,-7.85,;1.88,-9.3,;2.89,-10.44,;4.4,-10.13,;4.88,-8.67,;3.86,-7.54,;6.71,-1.39,;5.38,-.61,;8.04,-.61,)| Show InChI InChI=1S/C25H38N6O2/c1-18(32)30(15-6-5-14-28-25(26)27)21-9-11-22(12-10-21)31(19(2)33)16-13-20-17-29-24-8-4-3-7-23(20)24/h3-4,7-8,17,21-22,29H,5-6,9-16H2,1-2H3,(H4,26,27,28) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity towards human melanocortin 3 receptor (hMC3R) using [125I]NDP-alpha-MSH as radioligand |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50130012
(CHEMBL75185 | N-{4-[Acetyl-(4-guanidino-butyl)-ami...)Show SMILES CC(=O)N(CCCCNC(N)=N)C1CCC(CC1)N(CCc1c[nH]c2ccccc12)C(C)=O |(14.36,-.97,;13.01,-.22,;13,1.32,;11.7,-1,;10.35,-.24,;10.33,1.3,;9,2.05,;8.97,3.6,;7.63,4.36,;6.31,3.57,;4.96,4.33,;6.33,2.03,;11.7,-2.55,;10.93,-3.9,;9.22,-3.28,;8.04,-3.7,;8.8,-2.34,;10.44,-2.97,;6.71,-2.93,;5.38,-3.7,;5.37,-5.24,;4.02,-6.01,;2.62,-5.37,;1.59,-6.51,;2.36,-7.85,;1.88,-9.3,;2.89,-10.44,;4.4,-10.13,;4.88,-8.67,;3.86,-7.54,;6.71,-1.39,;5.38,-.61,;8.04,-.61,)| Show InChI InChI=1S/C25H38N6O2/c1-18(32)30(15-6-5-14-28-25(26)27)21-9-11-22(12-10-21)31(19(2)33)16-13-20-17-29-24-8-4-3-7-23(20)24/h3-4,7-8,17,21-22,29H,5-6,9-16H2,1-2H3,(H4,26,27,28) | PDB
KEGG
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| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity towards human melanocortin 4 receptor (hMC4R) using [125I]NDP-alpha-MSH as radioligand |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50130011
((S)-2-Acetylamino-N-(4-{acetyl-[2-(1H-indol-3-yl)-...)Show SMILES CC(=O)N[C@@H](Cc1ccccc1)C(=O)N(CCCCN)C1CCC(CC1)N(CCc1c[nH]c2ccccc12)C(C)=O |wU:4.3,(14.76,-.51,;13.43,-1.29,;13.44,-2.84,;12.09,-.54,;10.76,-1.32,;10.76,-2.86,;11.54,-4.19,;10.76,-5.52,;11.51,-6.84,;13.03,-6.85,;13.8,-5.53,;13.05,-4.19,;9.41,-.57,;9.4,.97,;8.09,-1.36,;6.74,-.59,;6.72,.95,;5.39,1.71,;5.36,3.25,;4.02,4.01,;8.1,-2.91,;7.33,-4.26,;5.61,-3.63,;4.43,-4.05,;5.19,-2.7,;6.83,-3.33,;3.09,-3.28,;1.76,-4.05,;1.75,-5.6,;.41,-6.37,;-1,-5.73,;-2.03,-6.87,;-1.26,-8.21,;-1.75,-9.66,;-.72,-10.81,;.78,-10.5,;1.26,-9.03,;.24,-7.9,;3.09,-1.74,;1.76,-.97,;4.43,-.97,)| Show InChI InChI=1S/C33H45N5O3/c1-24(39)36-32(22-26-10-4-3-5-11-26)33(41)38(20-9-8-19-34)29-16-14-28(15-17-29)37(25(2)40)21-18-27-23-35-31-13-7-6-12-30(27)31/h3-7,10-13,23,28-29,32,35H,8-9,14-22,34H2,1-2H3,(H,36,39)/t28?,29?,32-/m0/s1 | PDB
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| n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity towards human melanocortin 3 receptor (hMC3R) using [125I]NDP-alpha-MSH as radioligand |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50130013
((S)-2-Acetylamino-N-[4-(acetyl-methyl-amino)-cyclo...)Show SMILES CN(C1CCC(CC1)N(CCCCNC(N)=N)C(=O)[C@H](Cc1ccccc1)NC(C)=O)C(C)=O |wU:19.28,(-1.99,-5.9,;-.65,-5.13,;.68,-5.9,;1.43,-4.54,;3.07,-5.18,;4.33,-4.75,;3.59,-6.1,;1.86,-5.48,;4.33,-3.2,;2.99,-2.44,;2.98,-.9,;1.64,-.14,;1.62,1.4,;.27,2.17,;-1.05,1.38,;-2.4,2.14,;-1.04,-.16,;5.67,-2.42,;5.64,-.87,;7,-3.16,;7.02,-4.71,;7.79,-6.04,;9.31,-6.04,;10.06,-7.37,;9.29,-8.7,;7.76,-8.68,;7,-7.37,;8.33,-2.38,;9.68,-3.14,;11.01,-2.36,;9.69,-4.68,;-.65,-3.59,;-1.99,-2.81,;.68,-2.81,)| Show InChI InChI=1S/C25H40N6O3/c1-18(32)29-23(17-20-9-5-4-6-10-20)24(34)31(16-8-7-15-28-25(26)27)22-13-11-21(12-14-22)30(3)19(2)33/h4-6,9-10,21-23H,7-8,11-17H2,1-3H3,(H,29,32)(H4,26,27,28)/t21?,22?,23-/m0/s1 | PDB
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| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity towards human melanocortin 3 receptor (hMC3R) using [125I]NDP-alpha-MSH as radioligand |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Mus musculus) | BDBM50130012
(CHEMBL75185 | N-{4-[Acetyl-(4-guanidino-butyl)-ami...)Show SMILES CC(=O)N(CCCCNC(N)=N)C1CCC(CC1)N(CCc1c[nH]c2ccccc12)C(C)=O |(14.36,-.97,;13.01,-.22,;13,1.32,;11.7,-1,;10.35,-.24,;10.33,1.3,;9,2.05,;8.97,3.6,;7.63,4.36,;6.31,3.57,;4.96,4.33,;6.33,2.03,;11.7,-2.55,;10.93,-3.9,;9.22,-3.28,;8.04,-3.7,;8.8,-2.34,;10.44,-2.97,;6.71,-2.93,;5.38,-3.7,;5.37,-5.24,;4.02,-6.01,;2.62,-5.37,;1.59,-6.51,;2.36,-7.85,;1.88,-9.3,;2.89,-10.44,;4.4,-10.13,;4.88,-8.67,;3.86,-7.54,;6.71,-1.39,;5.38,-.61,;8.04,-.61,)| Show InChI InChI=1S/C25H38N6O2/c1-18(32)30(15-6-5-14-28-25(26)27)21-9-11-22(12-10-21)31(19(2)33)16-13-20-17-29-24-8-4-3-7-23(20)24/h3-4,7-8,17,21-22,29H,5-6,9-16H2,1-2H3,(H4,26,27,28) | KEGG
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| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity towards mouse Melanocortin 1 receptor (mMC1R) using [125I]NDP-alpha-MSH as radioligand |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 3
(Homo sapiens (Human)) | BDBM50130014
((R)-2-Acetylamino-N-(4-{acetyl-[2-(1H-indol-3-yl)-...)Show SMILES CC(=O)N[C@H](Cc1ccccc1)C(=O)N(CCCCNC(N)=N)C1CCC(CC1)N(CCc1c[nH]c2ccccc12)C(C)=O |wD:4.3,(14.52,1.42,;13.19,.63,;13.2,-.91,;11.84,1.39,;10.51,.61,;10.53,-.94,;11.29,-2.27,;12.81,-2.27,;13.57,-3.59,;12.8,-4.92,;11.27,-4.91,;10.51,-3.59,;9.17,1.37,;9.15,2.91,;7.84,.58,;6.5,1.35,;6.48,2.89,;5.14,3.64,;5.13,5.18,;3.77,5.94,;2.46,5.16,;1.11,5.93,;2.46,3.62,;7.86,-.97,;7.09,-2.32,;5.36,-1.71,;4.19,-2.13,;4.94,-.77,;6.58,-1.39,;2.85,-1.36,;1.52,-2.13,;1.5,-3.67,;.17,-4.43,;-1.24,-3.8,;-2.28,-4.94,;-1.51,-6.27,;-1.99,-7.72,;-.97,-8.88,;.55,-8.57,;1.01,-7.11,;,-5.97,;2.85,.19,;1.52,.96,;4.19,.96,)| Show InChI InChI=1S/C34H47N7O3/c1-24(42)39-32(22-26-10-4-3-5-11-26)33(44)41(20-9-8-19-37-34(35)36)29-16-14-28(15-17-29)40(25(2)43)21-18-27-23-38-31-13-7-6-12-30(27)31/h3-7,10-13,23,28-29,32,38H,8-9,14-22H2,1-2H3,(H,39,42)(H4,35,36,37)/t28?,29?,32-/m1/s1 | PDB
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| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity towards human melanocortin 3 receptor (hMC3R) using [125I]NDP-alpha-MSH as radioligand |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Mus musculus) | BDBM50130014
((R)-2-Acetylamino-N-(4-{acetyl-[2-(1H-indol-3-yl)-...)Show SMILES CC(=O)N[C@H](Cc1ccccc1)C(=O)N(CCCCNC(N)=N)C1CCC(CC1)N(CCc1c[nH]c2ccccc12)C(C)=O |wD:4.3,(14.52,1.42,;13.19,.63,;13.2,-.91,;11.84,1.39,;10.51,.61,;10.53,-.94,;11.29,-2.27,;12.81,-2.27,;13.57,-3.59,;12.8,-4.92,;11.27,-4.91,;10.51,-3.59,;9.17,1.37,;9.15,2.91,;7.84,.58,;6.5,1.35,;6.48,2.89,;5.14,3.64,;5.13,5.18,;3.77,5.94,;2.46,5.16,;1.11,5.93,;2.46,3.62,;7.86,-.97,;7.09,-2.32,;5.36,-1.71,;4.19,-2.13,;4.94,-.77,;6.58,-1.39,;2.85,-1.36,;1.52,-2.13,;1.5,-3.67,;.17,-4.43,;-1.24,-3.8,;-2.28,-4.94,;-1.51,-6.27,;-1.99,-7.72,;-.97,-8.88,;.55,-8.57,;1.01,-7.11,;,-5.97,;2.85,.19,;1.52,.96,;4.19,.96,)| Show InChI InChI=1S/C34H47N7O3/c1-24(42)39-32(22-26-10-4-3-5-11-26)33(44)41(20-9-8-19-37-34(35)36)29-16-14-28(15-17-29)40(25(2)43)21-18-27-23-38-31-13-7-6-12-30(27)31/h3-7,10-13,23,28-29,32,38H,8-9,14-22H2,1-2H3,(H,39,42)(H4,35,36,37)/t28?,29?,32-/m1/s1 | KEGG
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| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity towards mouse Melanocortin 1 receptor (mMC1R) using [125I]NDP-alpha-MSH as radioligand |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50130013
((S)-2-Acetylamino-N-[4-(acetyl-methyl-amino)-cyclo...)Show SMILES CN(C1CCC(CC1)N(CCCCNC(N)=N)C(=O)[C@H](Cc1ccccc1)NC(C)=O)C(C)=O |wU:19.28,(-1.99,-5.9,;-.65,-5.13,;.68,-5.9,;1.43,-4.54,;3.07,-5.18,;4.33,-4.75,;3.59,-6.1,;1.86,-5.48,;4.33,-3.2,;2.99,-2.44,;2.98,-.9,;1.64,-.14,;1.62,1.4,;.27,2.17,;-1.05,1.38,;-2.4,2.14,;-1.04,-.16,;5.67,-2.42,;5.64,-.87,;7,-3.16,;7.02,-4.71,;7.79,-6.04,;9.31,-6.04,;10.06,-7.37,;9.29,-8.7,;7.76,-8.68,;7,-7.37,;8.33,-2.38,;9.68,-3.14,;11.01,-2.36,;9.69,-4.68,;-.65,-3.59,;-1.99,-2.81,;.68,-2.81,)| Show InChI InChI=1S/C25H40N6O3/c1-18(32)29-23(17-20-9-5-4-6-10-20)24(34)31(16-8-7-15-28-25(26)27)22-13-11-21(12-14-22)30(3)19(2)33/h4-6,9-10,21-23H,7-8,11-17H2,1-3H3,(H,29,32)(H4,26,27,28)/t21?,22?,23-/m0/s1 | PDB
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| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity towards human melanocortin 4 receptor (hMC4R) using [125I]NDP-alpha-MSH as radioligand |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Mus musculus) | BDBM50130011
((S)-2-Acetylamino-N-(4-{acetyl-[2-(1H-indol-3-yl)-...)Show SMILES CC(=O)N[C@@H](Cc1ccccc1)C(=O)N(CCCCN)C1CCC(CC1)N(CCc1c[nH]c2ccccc12)C(C)=O |wU:4.3,(14.76,-.51,;13.43,-1.29,;13.44,-2.84,;12.09,-.54,;10.76,-1.32,;10.76,-2.86,;11.54,-4.19,;10.76,-5.52,;11.51,-6.84,;13.03,-6.85,;13.8,-5.53,;13.05,-4.19,;9.41,-.57,;9.4,.97,;8.09,-1.36,;6.74,-.59,;6.72,.95,;5.39,1.71,;5.36,3.25,;4.02,4.01,;8.1,-2.91,;7.33,-4.26,;5.61,-3.63,;4.43,-4.05,;5.19,-2.7,;6.83,-3.33,;3.09,-3.28,;1.76,-4.05,;1.75,-5.6,;.41,-6.37,;-1,-5.73,;-2.03,-6.87,;-1.26,-8.21,;-1.75,-9.66,;-.72,-10.81,;.78,-10.5,;1.26,-9.03,;.24,-7.9,;3.09,-1.74,;1.76,-.97,;4.43,-.97,)| Show InChI InChI=1S/C33H45N5O3/c1-24(39)36-32(22-26-10-4-3-5-11-26)33(41)38(20-9-8-19-34)29-16-14-28(15-17-29)37(25(2)40)21-18-27-23-35-31-13-7-6-12-30(27)31/h3-7,10-13,23,28-29,32,35H,8-9,14-22,34H2,1-2H3,(H,36,39)/t28?,29?,32-/m0/s1 | KEGG
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| n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity towards mouse Melanocortin 1 receptor (mMC1R) using [125I]NDP-alpha-MSH as radioligand |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50130014
((R)-2-Acetylamino-N-(4-{acetyl-[2-(1H-indol-3-yl)-...)Show SMILES CC(=O)N[C@H](Cc1ccccc1)C(=O)N(CCCCNC(N)=N)C1CCC(CC1)N(CCc1c[nH]c2ccccc12)C(C)=O |wD:4.3,(14.52,1.42,;13.19,.63,;13.2,-.91,;11.84,1.39,;10.51,.61,;10.53,-.94,;11.29,-2.27,;12.81,-2.27,;13.57,-3.59,;12.8,-4.92,;11.27,-4.91,;10.51,-3.59,;9.17,1.37,;9.15,2.91,;7.84,.58,;6.5,1.35,;6.48,2.89,;5.14,3.64,;5.13,5.18,;3.77,5.94,;2.46,5.16,;1.11,5.93,;2.46,3.62,;7.86,-.97,;7.09,-2.32,;5.36,-1.71,;4.19,-2.13,;4.94,-.77,;6.58,-1.39,;2.85,-1.36,;1.52,-2.13,;1.5,-3.67,;.17,-4.43,;-1.24,-3.8,;-2.28,-4.94,;-1.51,-6.27,;-1.99,-7.72,;-.97,-8.88,;.55,-8.57,;1.01,-7.11,;,-5.97,;2.85,.19,;1.52,.96,;4.19,.96,)| Show InChI InChI=1S/C34H47N7O3/c1-24(42)39-32(22-26-10-4-3-5-11-26)33(44)41(20-9-8-19-37-34(35)36)29-16-14-28(15-17-29)40(25(2)43)21-18-27-23-38-31-13-7-6-12-30(27)31/h3-7,10-13,23,28-29,32,38H,8-9,14-22H2,1-2H3,(H,39,42)(H4,35,36,37)/t28?,29?,32-/m1/s1 | PDB
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| n/a | n/a | n/a | n/a | 680 | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Intracellular levels of cAMP in HEK 293 cells expressing human melanocortin 4 receptor (hMC4R) |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50130014
((R)-2-Acetylamino-N-(4-{acetyl-[2-(1H-indol-3-yl)-...)Show SMILES CC(=O)N[C@H](Cc1ccccc1)C(=O)N(CCCCNC(N)=N)C1CCC(CC1)N(CCc1c[nH]c2ccccc12)C(C)=O |wD:4.3,(14.52,1.42,;13.19,.63,;13.2,-.91,;11.84,1.39,;10.51,.61,;10.53,-.94,;11.29,-2.27,;12.81,-2.27,;13.57,-3.59,;12.8,-4.92,;11.27,-4.91,;10.51,-3.59,;9.17,1.37,;9.15,2.91,;7.84,.58,;6.5,1.35,;6.48,2.89,;5.14,3.64,;5.13,5.18,;3.77,5.94,;2.46,5.16,;1.11,5.93,;2.46,3.62,;7.86,-.97,;7.09,-2.32,;5.36,-1.71,;4.19,-2.13,;4.94,-.77,;6.58,-1.39,;2.85,-1.36,;1.52,-2.13,;1.5,-3.67,;.17,-4.43,;-1.24,-3.8,;-2.28,-4.94,;-1.51,-6.27,;-1.99,-7.72,;-.97,-8.88,;.55,-8.57,;1.01,-7.11,;,-5.97,;2.85,.19,;1.52,.96,;4.19,.96,)| Show InChI InChI=1S/C34H47N7O3/c1-24(42)39-32(22-26-10-4-3-5-11-26)33(44)41(20-9-8-19-37-34(35)36)29-16-14-28(15-17-29)40(25(2)43)21-18-27-23-38-31-13-7-6-12-30(27)31/h3-7,10-13,23,28-29,32,38H,8-9,14-22H2,1-2H3,(H,39,42)(H4,35,36,37)/t28?,29?,32-/m1/s1 | PDB
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PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 680 | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Intracellular levels of cAMP in HEK 293 cells expressing human melanocortin 4 receptor (hMC4R) |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Homo sapiens (Human)) | BDBM50130009
((4S,15R,18S,21S,24S)-5-((S)-2-Acetylamino-hexanoyl...)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](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C1=O)C(N)=O Show InChI InChI=1S/C49H69N13O9/c1-3-4-17-35(56-29(2)63)43(66)61-39-27-41(64)53-22-11-10-19-34(42(50)65)57-46(69)38(26-31-28-55-33-18-9-8-16-32(31)33)59-44(67)36(20-12-23-54-49(51)52)58-45(68)37(25-30-14-6-5-7-15-30)60-47(70)40-21-13-24-62(40)48(39)71/h5-9,14-16,18,28,34-40,55H,3-4,10-13,17,19-27H2,1-2H3,(H2,50,65)(H,53,64)(H,56,63)(H,57,69)(H,58,68)(H,59,67)(H,60,70)(H,61,66)(H4,51,52,54)/t34-,35+,36+,37+,38-,39+,40+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | n/a | n/a | 0.170 | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Intracellular levels of cAMP in HEK 293 cells expressing human melanocortin 4 receptor (hMC4R) |
Bioorg Med Chem Lett 13: 2337-40 (2003)
BindingDB Entry DOI: 10.7270/Q21G0MTZ |
More data for this
Ligand-Target Pair | |
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