Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Melanocortin receptor 4' and Ligand = 'BDBM50245677'   

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))	BDBM50245677 (3-amino-N-((R)-3-(2,4-dichlorophenyl)-1-(4-(2-(1-h...) Show SMILES COc1ccc(CCC(O)c2ccccc2N2CCN(CC2)C(=O)[C@@H](Cc2ccc(Cl)cc2Cl)NC(=O)CCN)cc1 |r| Show InChI InChI=1S/C32H38Cl2N4O4/c1-42-25-11-6-22(7-12-25)8-13-30(39)26-4-2-3-5-29(26)37-16-18-38(19-17-37)32(41)28(36-31(40)14-15-35)20-23-9-10-24(33)21-27(23)34/h2-7,9-12,21,28,30,39H,8,13-20,35H2,1H3,(H,36,40)/t28-,30?/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	23	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Binding affinity to human MC4 receptor				Bioorg Med Chem Lett 18: 4817-22 (2008) Article DOI: 10.1016/j.bmcl.2008.07.076 BindingDB Entry DOI: 10.7270/Q24T6J75
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