Found 2 hits Enz. Inhib. hit(s) with Target = 'Melanocyte-stimulating hormone receptor' and Ligand = 'BDBM50174075' 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)) | BDBM50174075
(1-Pentanoylamino-4-phenyl-cyclohexanecarboxylic ac...)Show SMILES CCCCC(=O)N[C@@]1(CC[C@@H](CC1)c1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:44.46,7.6,10.13,wD:7.20,22.23,33.35,(-8.92,-.75,;-7.61,-1.51,;-6.29,-.76,;-4.97,-1.52,;-3.64,-.76,;-3.64,.77,;-2.32,-1.53,;-1.94,-3,;-3.32,-2.38,;-4.53,-3.28,;-4.38,-4.78,;-2.99,-5.4,;-1.77,-4.5,;-5.6,-5.66,;-6.97,-5.04,;-8.2,-5.95,;-8.05,-7.44,;-6.65,-8.06,;-5.45,-7.16,;-.71,-2.1,;-.88,-.59,;.67,-2.71,;1.89,-1.82,;1.89,-.26,;2.3,1.26,;1.17,2.35,;1.56,3.87,;3.07,4.3,;4.19,3.19,;3.8,1.68,;3.18,-2.68,;3.18,-4.24,;4.53,-1.94,;5.77,-2.85,;5.77,-4.4,;7.11,-5.17,;7.11,-6.72,;8.44,-7.44,;9.79,-8.27,;9.79,-9.82,;11.13,-7.49,;7.05,-1.97,;7.06,-.42,;8.42,-2.71,;9.64,-1.82,;9.64,-.26,;10.15,1.21,;11.63,1.67,;11.65,3.22,;10.2,3.72,;9.58,5.14,;8.05,5.33,;7.12,4.1,;7.72,2.68,;9.27,2.48,;10.93,-2.68,;12.3,-1.94,;10.95,-4.24,)| Show InChI InChI=1S/C44H57N9O5/c1-2-3-20-38(54)53-44(23-21-31(22-24-44)30-15-8-5-9-16-30)42(58)52-37(26-29-13-6-4-7-14-29)41(57)50-35(19-12-25-48-43(46)47)40(56)51-36(39(45)55)27-32-28-49-34-18-11-10-17-33(32)34/h4-11,13-18,28,31,35-37,49H,2-3,12,19-27H2,1H3,(H2,45,55)(H,50,57)(H,51,56)(H,52,58)(H,53,54)(H4,46,47,48)/t31-,35-,36-,37+,44+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Agonist activity in HEK293 cells transfected with human MC1R by cAMP accumulation |
Bioorg Med Chem Lett 15: 5504-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.083
BindingDB Entry DOI: 10.7270/Q2MC8ZK7 |
More data for this
Ligand-Target Pair | |
Melanocyte-stimulating hormone receptor
(Homo sapiens (Human)) | BDBM50174075
(1-Pentanoylamino-4-phenyl-cyclohexanecarboxylic ac...)Show SMILES CCCCC(=O)N[C@@]1(CC[C@@H](CC1)c1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:44.46,7.6,10.13,wD:7.20,22.23,33.35,(-8.92,-.75,;-7.61,-1.51,;-6.29,-.76,;-4.97,-1.52,;-3.64,-.76,;-3.64,.77,;-2.32,-1.53,;-1.94,-3,;-3.32,-2.38,;-4.53,-3.28,;-4.38,-4.78,;-2.99,-5.4,;-1.77,-4.5,;-5.6,-5.66,;-6.97,-5.04,;-8.2,-5.95,;-8.05,-7.44,;-6.65,-8.06,;-5.45,-7.16,;-.71,-2.1,;-.88,-.59,;.67,-2.71,;1.89,-1.82,;1.89,-.26,;2.3,1.26,;1.17,2.35,;1.56,3.87,;3.07,4.3,;4.19,3.19,;3.8,1.68,;3.18,-2.68,;3.18,-4.24,;4.53,-1.94,;5.77,-2.85,;5.77,-4.4,;7.11,-5.17,;7.11,-6.72,;8.44,-7.44,;9.79,-8.27,;9.79,-9.82,;11.13,-7.49,;7.05,-1.97,;7.06,-.42,;8.42,-2.71,;9.64,-1.82,;9.64,-.26,;10.15,1.21,;11.63,1.67,;11.65,3.22,;10.2,3.72,;9.58,5.14,;8.05,5.33,;7.12,4.1,;7.72,2.68,;9.27,2.48,;10.93,-2.68,;12.3,-1.94,;10.95,-4.24,)| Show InChI InChI=1S/C44H57N9O5/c1-2-3-20-38(54)53-44(23-21-31(22-24-44)30-15-8-5-9-16-30)42(58)52-37(26-29-13-6-4-7-14-29)41(57)50-35(19-12-25-48-43(46)47)40(56)51-36(39(45)55)27-32-28-49-34-18-11-10-17-33(32)34/h4-11,13-18,28,31,35-37,49H,2-3,12,19-27H2,1H3,(H2,45,55)(H,50,57)(H,51,56)(H,52,58)(H,53,54)(H4,46,47,48)/t31-,35-,36-,37+,44+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Effective concentration required for cAMP accumulation mediated by human Melanocortin 1 receptor in HEK293 cells |
Bioorg Med Chem Lett 15: 4910-4 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.012
BindingDB Entry DOI: 10.7270/Q28915D1 |
More data for this
Ligand-Target Pair | |
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