Reaction Details Report a problem with these data
Target
Melanocortin receptor 4
Ligand
BDBM50119367
Substrate
n/a
Meas. Tech.
ChEMBL_104242 (CHEMBL712747)
IC50
0.300000±n/a nM
Citation
 Sebhat, IK; Martin, WJ; Ye, Z; Barakat, K; Mosley, RT; Johnston, DB; Bakshi, R; Palucki, B; Weinberg, DH; MacNeil, T; Kalyani, RN; Tang, R; Stearns, RA; Miller, RR; Tamvakopoulos, C; Strack, AM; McGowan, E; Cashen, DE; Drisko, JE; Hom, GJ; Howard, AD; MacIntyre, DE; van der Ploeg, LH; Patchett, AA; Nargund, RP Design and pharmacology of N-[(3R)-1,2,3,4-tetrahydroisoquinolinium- 3-ylcarbonyl]-(1R)-1-(4-chlorobenzyl)- 2-[4-cyclohexyl-4-(1H-1,2,4-triazol- 1-ylmethyl)piperidin-1-yl]-2-oxoethylamine (1), a potent, selective, melanocortin subtype-4 receptor agonist. J Med Chem 45:4589-93 (2002) [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:
BDBM50119367
Synonyms:
(3R)-N-[(2R)-3-(4-chlorophenyl)-1-{4-cyclohexyl-4-[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-yl}-1-oxopropan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide | 1,2,3,4-Tetrahydro-isoquinoline-3-carboxylic acid {1-(4-chloro-benzyl)-2-[4-cyclohexyl-4-(1-methyl-1H-tetrazol-5-ylmethyl)-piperidin-1-yl]-2-oxo-ethyl}-amide | CHEMBL140154
Type:
Small organic molecule
Emp. Form.:
C33H42ClN7O2
Mol. Mass.:
604.185
SMILES:
Cn1nnnc1CC1(CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1)C1CCCCC1
Structure:
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