Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-V/beta-3' and Ligand = 'BDBM50083838'   

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))	BDBM50083838 (2-(3-Phenyl-ureido)-3-({1-[3-(pyridin-2-ylamino)-p...) Show SMILES OC(=O)[C@H](CNC(=O)c1ccc2n(CCCNc3ccccn3)ncc2c1)NC(=O)Nc1ccccc1 Show InChI InChI=1S/C26H27N7O4/c34-24(29-17-21(25(35)36)32-26(37)31-20-7-2-1-3-8-20)18-10-11-22-19(15-18)16-30-33(22)14-6-13-28-23-9-4-5-12-27-23/h1-5,7-12,15-16,21H,6,13-14,17H2,(H,27,28)(H,29,34)(H,35,36)(H2,31,32,37)/t21-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhbitory activity against beta3-transfected 293 cells using alpha-V beta-3 antagonism assay				J Med Chem 43: 41-58 (2000) BindingDB Entry DOI: 10.7270/Q21G0KG2
					More data for this Ligand-Target Pair