Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-V/beta-3' and Ligand = 'BDBM50083777'   

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))	BDBM50083777 (3-({5-[4-(Isoquinolin-3-ylamino)-butyl]-4,5-dihydr...) Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N[C@@H](CNC(=O)C1=NOC(CCCCNc2cc3ccccc3cn2)C1)C(O)=O |t:19| Show InChI InChI=1S/C29H35N5O6S/c1-18-12-19(2)27(20(3)13-18)41(38,39)34-25(29(36)37)17-32-28(35)24-15-23(40-33-24)10-6-7-11-30-26-14-21-8-4-5-9-22(21)16-31-26/h4-5,8-9,12-14,16,23,25,34H,6-7,10-11,15,17H2,1-3H3,(H,30,31)(H,32,35)(H,36,37)/t23?,25-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem 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 Inhibition of vitronectin receptor (alpha V beta 3), expressed on human 293 cells, binding to immobilized fibrinogen				J Med Chem 43: 27-40 (2000) BindingDB Entry DOI: 10.7270/Q2571B77
					More data for this Ligand-Target Pair