Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-V/beta-3' and Ligand = 'BDBM50166670'   

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))	BDBM50166670 (2-{5-[3-(Pyridin-2-ylamino)-propoxy]-indol-1-ylmet...) Show SMILES CCCC(Cn1ccc2cc(OCCCNc3ccccn3)ccc12)C(O)=O Show InChI InChI=1S/C22H27N3O3/c1-2-6-18(22(26)27)16-25-13-10-17-15-19(8-9-20(17)25)28-14-5-12-24-21-7-3-4-11-23-21/h3-4,7-11,13,15,18H,2,5-6,12,14,16H2,1H3,(H,23,24)(H,26,27)	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johnson& Johnson, Pharmaceutical Research and Development, L.L.C. Curated by ChEMBL					Assay Description Inhibitory concentration against alphaV-beta3 integrin				Bioorg Med Chem Lett 15: 2679-84 (2005) Article DOI: 10.1016/j.bmcl.2005.01.028 BindingDB Entry DOI: 10.7270/Q2N29Z40
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