Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Melanocortin receptor 4' and Ligand = 'BDBM50027131'   

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))	BDBM50027131 (CHEMBL2145454) Show SMILES OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.CC(C)(C)NC(=O)C1(CCN(CC1)C(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)[C@@H]1CN(CC(F)F)CCN1)C1CCCCC1 Show InChI InChI=1S/C32H48F3N5O3/c1-31(2,3)38-30(43)32(23-7-5-4-6-8-23)13-16-40(17-14-32)29(42)25(19-22-9-11-24(33)12-10-22)37-28(41)26-20-39(18-15-36-26)21-27(34)35/h9-12,23,25-27,36H,4-8,13-21H2,1-3H3,(H,37,41)(H,38,43)/t25-,26+/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Concentration for 50% inhibition of human melanocortin-4 receptor expressed in CHO cells using [125I]NDP-alpha-MSH as radioligand				Bioorg Med Chem Lett 15: 171-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.020 BindingDB Entry DOI: 10.7270/Q2G44R2V
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50027131 (CHEMBL2145454) Show SMILES OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.CC(C)(C)NC(=O)C1(CCN(CC1)C(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)[C@@H]1CN(CC(F)F)CCN1)C1CCCCC1 Show InChI InChI=1S/C32H48F3N5O3/c1-31(2,3)38-30(43)32(23-7-5-4-6-8-23)13-16-40(17-14-32)29(42)25(19-22-9-11-24(33)12-10-22)37-28(41)26-20-39(18-15-36-26)21-27(34)35/h9-12,23,25-27,36H,4-8,13-21H2,1-3H3,(H,37,41)(H,38,43)/t25-,26+/m1/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	52	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Effective concentration towards human melanocortin-4 receptor mediated cAMP accumulation in CHO cells				Bioorg Med Chem Lett 15: 171-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.020 BindingDB Entry DOI: 10.7270/Q2G44R2V
					More data for this Ligand-Target Pair