Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Melanocortin receptor 4' and Ligand = 'BDBM50253750'   

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))	BDBM50253750 ((3S)-N-((1R)-1-[(4-Fluorophenyl)methyl]-2-{(2S)-4-...) Show SMILES CCC[C@@H]1N(CCN([C@@H](Cc2ccc3ccccc3c2)C(=O)NC)C1=O)C(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)[C@@H]1Cc2ccccc2CN1 |r| Show InChI InChI=1S/C40H44FN5O4/c1-3-8-35-40(50)46(36(38(48)42-2)23-27-13-16-28-9-4-5-10-29(28)21-27)20-19-45(35)39(49)34(22-26-14-17-32(41)18-15-26)44-37(47)33-24-30-11-6-7-12-31(30)25-43-33/h4-7,9-18,21,33-36,43H,3,8,19-20,22-25H2,1-2H3,(H,42,48)(H,44,47)/t33-,34+,35-,36-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of europium-labeled NDP-alpha-MSH from human MC4R expressed in HEK293 cells				J Med Chem 51: 6055-66 (2008) Article DOI: 10.1021/jm800525p BindingDB Entry DOI: 10.7270/Q2DV1JQC
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50253750 ((3S)-N-((1R)-1-[(4-Fluorophenyl)methyl]-2-{(2S)-4-...) Show SMILES CCC[C@@H]1N(CCN([C@@H](Cc2ccc3ccccc3c2)C(=O)NC)C1=O)C(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)[C@@H]1Cc2ccccc2CN1 |r| Show InChI InChI=1S/C40H44FN5O4/c1-3-8-35-40(50)46(36(38(48)42-2)23-27-13-16-28-9-4-5-10-29(28)21-27)20-19-45(35)39(49)34(22-26-14-17-32(41)18-15-26)44-37(47)33-24-30-11-6-7-12-31(30)25-43-33/h4-7,9-18,21,33-36,43H,3,8,19-20,22-25H2,1-2H3,(H,42,48)(H,44,47)/t33-,34+,35-,36-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.800	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Agonist activity at human MC4R expressed in HEK293 cells assessed as effect on CRE-driven luminescence by luciferase reporter gene assay				J Med Chem 51: 6055-66 (2008) Article DOI: 10.1021/jm800525p BindingDB Entry DOI: 10.7270/Q2DV1JQC
					More data for this Ligand-Target Pair