Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Melanocortin receptor 5' and Ligand = 'BDBM50453129'   

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 5 (Homo sapiens (Human))	BDBM50453129 (CHEMBL4216242) Show SMILES NC(=N)NCCC[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)C2(CCC2)NC(=O)CC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(N)=O |r| Show InChI InChI=1S/C42H53N13O7/c43-35(57)29-13-14-34(56)55-42(15-7-16-42)40(62)54-33(20-26-22-46-23-49-26)39(61)52-31(18-24-8-2-1-3-9-24)37(59)51-30(12-6-17-47-41(44)45)36(58)53-32(38(60)50-29)19-25-21-48-28-11-5-4-10-27(25)28/h1-5,8-11,21-23,29-33,48H,6-7,12-20H2,(H2,43,57)(H,46,49)(H,50,60)(H,51,59)(H,52,61)(H,53,58)(H,54,62)(H,55,56)(H4,44,45,47)/t29-,30-,31+,32-,33-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples "Federico II" Curated by ChEMBL					Assay Description Displacement of [125I]-NDP-alpha-MSH from human MC5R expressed in HEK293 cells after 40 mins by gamma counting method				J Med Chem 61: 4263-4269 (2018) Article DOI: 10.1021/acs.jmedchem.8b00488 BindingDB Entry DOI: 10.7270/Q22J6FF7
					More data for this Ligand-Target Pair
Melanocortin receptor 5 (Homo sapiens (Human))	BDBM50453129 (CHEMBL4216242) Show SMILES NC(=N)NCCC[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)C2(CCC2)NC(=O)CC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(N)=O |r| Show InChI InChI=1S/C42H53N13O7/c43-35(57)29-13-14-34(56)55-42(15-7-16-42)40(62)54-33(20-26-22-46-23-49-26)39(61)52-31(18-24-8-2-1-3-9-24)37(59)51-30(12-6-17-47-41(44)45)36(58)53-32(38(60)50-29)19-25-21-48-28-11-5-4-10-27(25)28/h1-5,8-11,21-23,29-33,48H,6-7,12-20H2,(H2,43,57)(H,46,49)(H,50,60)(H,51,59)(H,52,61)(H,53,58)(H,54,62)(H,55,56)(H4,44,45,47)/t29-,30-,31+,32-,33-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2	n/a	n/a	n/a	n/a
University of Naples "Federico II" Curated by ChEMBL					Assay Description Agonist activity at human MC5R expressed in HEK293 cells assessed as induction of intracellular cAMP accumulation after 3 mins				J Med Chem 61: 4263-4269 (2018) Article DOI: 10.1021/acs.jmedchem.8b00488 BindingDB Entry DOI: 10.7270/Q22J6FF7
					More data for this Ligand-Target Pair