Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-V/beta-3' and Ligand = 'BDBM50059127'   

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
Integrin alpha-V/beta-3 (Homo sapiens (Human))	BDBM50059127 (CHEMBL74081 | [4-Methyl-3-oxo-7-(4-pyridin-4-yl-pi...) Show SMILES CN1Cc2cc(ccc2NC(CC(O)=O)C1=O)C(=O)N1CCN(CC1)c1ccncc1 Show InChI InChI=1S/C22H25N5O4/c1-25-14-16-12-15(2-3-18(16)24-19(22(25)31)13-20(28)29)21(30)27-10-8-26(9-11-27)17-4-6-23-7-5-17/h2-7,12,19,24H,8-11,13-14H2,1H3,(H,28,29)	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Affinity for vitronectin receptor, integrin alphaV-beta3				J Med Chem 40: 2289-92 (1997) Article DOI: 10.1021/jm970205r BindingDB Entry DOI: 10.7270/Q22V2F74
					More data for this Ligand-Target Pair