Reaction Details Report a problem with these data
Target
Melanocortin receptor 4
Ligand
BDBM50190976
Substrate
n/a
Meas. Tech.
ChEMBL_397863 (CHEMBL856324)
IC50
1700±n/a nM
Citation
 Chen, CW; Tran, JA; Jiang, W; Tucci, FC; Arellano, M; Wen, J; Fleck, BA; Marinkovic, D; White, NS; Pontillo, J; Saunders, J; Madan, A; Foster, AC; Chen, C Propionylpiperazines as human melanocortin-4 receptor ligands. Bioorg Med Chem Lett 16:4800-3 (2006) [PubMed]  Article 
Target
Name:
Melanocortin receptor 4
Synonyms:
MC4-R | MC4R | MC4R_HUMAN | Melanocortin MC4 | Melanocortin receptor 4 (MC-4) | Melanocortin receptor 4 (MC4-R) | Melanocortin receptor 4 (MC4R)
Type:
Enzyme
Mol. Mass.:
36949.50
Organism:
Homo sapiens (Human)
Description:
P32245
Residue:
332
Sequence:
MVNSTHRGMHTSLHLWNRSSYRLHSNASESLGKGYSDGGCYEQLFVSPEVFVTLGVISLLENILVIVAIAKNKNLHSPMYFFICSLAVADMLVSVSNGSETIVITLLNSTDTDAQSFTVNIDNVIDSVICSSLLASICSLLSIAVDRYFTIFYALQYHNIMTVKRVGIIISCIWAACTVSGILFIIYSDSSAVIICLITMFFTMLALMASLYVHMFLMARLHIKRIAVLPGTGAIRQGANMKGAITLTILIGVFVVCWAPFFLHLIFYISCPQNPYCVCFMSHFNLYLILIMCNSIIDPLIYALRSQELRKTFKEIICCYPLGGLCDLSSRY
  
Inhibitor
Name:
BDBM50190976
Synonyms:
(1S)-[2-{4-[2-methyl-3-(2-methoxy-4-chlorophenyl)propionyl]-1-piperazinyl}-5-(trifluoromethyl)phenyl]-3-methylbutylamine | 1-(4-(2-((S)-1-amino-3-methylbutyl)-4-(trifluoromethyl)phenyl)piperazin-1-yl)-3-(4-chloro-2-methoxyphenyl)-2-methylpropan-1-one | CHEMBL377231
Type:
Small organic molecule
Emp. Form.:
C27H35ClF3N3O2
Mol. Mass.:
526.034
SMILES:
COc1cc(Cl)ccc1CC(C)C(=O)N1CCN(CC1)c1ccc(cc1[C@@H](N)CC(C)C)C(F)(F)F
Structure:
Search PDB for entries with ligand similarity: