Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-V/beta-3' and Ligand = 'BDBM50083823'   

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))	BDBM50083823 (3-({1-[3-(1H-Imidazol-2-ylamino)-propyl]-1H-indazo...) Show SMILES OC(=O)[C@H](CNC(=O)c1ccc2n(CCCNc3ncc[nH]3)ncc2c1)NS(=O)(=O)c1ccc2ccccc2c1 Show InChI InChI=1S/C27H27N7O5S/c35-25(20-7-9-24-21(14-20)16-32-34(24)13-3-10-28-27-29-11-12-30-27)31-17-23(26(36)37)33-40(38,39)22-8-6-18-4-1-2-5-19(18)15-22/h1-2,4-9,11-12,14-16,23,33H,3,10,13,17H2,(H,31,35)(H,36,37)(H2,28,29,30)/t23-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.70	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