Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Melanocortin receptor 4' and Ligand = 'BDBM50323458'   

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))	BDBM50323458 ((S)-(6-chloro-3-(2-((S)-3-hydroxypyrrolidin-1-yl)p...) Show SMILES Cc1cc2[C@H](OC3(CCN(CC3)C(=O)[C@@H]3CN(C[C@H]3c3ccc(F)cc3F)C3CCOCC3)c2cc1Cl)C(C)(C)N1CC[C@H](O)C1 |r| Show InChI InChI=1S/C36H46ClF2N3O4/c1-22-16-27-30(18-31(22)37)36(46-33(27)35(2,3)42-11-6-25(43)19-42)9-12-40(13-10-36)34(44)29-21-41(24-7-14-45-15-8-24)20-28(29)26-5-4-23(38)17-32(26)39/h4-5,16-18,24-25,28-29,33,43H,6-15,19-21H2,1-3H3/t25-,28-,29+,33-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [125I]NDP-alpha-MSH from human melanocortin 4 receptor expressed in CHO cells				Bioorg Med Chem Lett 20: 4895-900 (2010) Article DOI: 10.1016/j.bmcl.2010.06.068 BindingDB Entry DOI: 10.7270/Q2TB172P
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50323458 ((S)-(6-chloro-3-(2-((S)-3-hydroxypyrrolidin-1-yl)p...) Show SMILES Cc1cc2[C@H](OC3(CCN(CC3)C(=O)[C@@H]3CN(C[C@H]3c3ccc(F)cc3F)C3CCOCC3)c2cc1Cl)C(C)(C)N1CC[C@H](O)C1 |r| Show InChI InChI=1S/C36H46ClF2N3O4/c1-22-16-27-30(18-31(22)37)36(46-33(27)35(2,3)42-11-6-25(43)19-42)9-12-40(13-10-36)34(44)29-21-41(24-7-14-45-15-8-24)20-28(29)26-5-4-23(38)17-32(26)39/h4-5,16-18,24-25,28-29,33,43H,6-15,19-21H2,1-3H3/t25-,28-,29+,33-/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
Merck Research Laboratories Curated by ChEMBL					Assay Description Agonist activity at human melanocortin 4 receptor expressed in CHO cells assessed as cAMP release				Bioorg Med Chem Lett 20: 4895-900 (2010) Article DOI: 10.1016/j.bmcl.2010.06.068 BindingDB Entry DOI: 10.7270/Q2TB172P
					More data for this Ligand-Target Pair