Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-V' and Ligand = 'BDBM50296631'   

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 (Homo sapiens (Human))	BDBM50296631 ((R)-3-(1-oxoisoindolin-2-yl)-2-(2,4,6-trimethylphe...) Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N[C@H](CN1Cc2ccccc2C1=O)C(O)=O |r| Show InChI InChI=1S/C20H22N2O5S/c1-12-8-13(2)18(14(3)9-12)28(26,27)21-17(20(24)25)11-22-10-15-6-4-5-7-16(15)19(22)23/h4-9,17,21H,10-11H2,1-3H3,(H,24,25)/t17-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	975	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of fibrinogen binding to alphavbeta3 integrin				Bioorg Med Chem Lett 19: 4832-5 (2009) Article DOI: 10.1016/j.bmcl.2009.06.041 BindingDB Entry DOI: 10.7270/Q2CJ8DJQ
					More data for this Ligand-Target Pair