Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-5/beta-1' and Ligand = 'BDBM50429468'   

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-5/beta-1 (Homo sapiens (Human))	BDBM50429468 (CHEMBL2332832) Show SMILES [#7]\[#6](-[#7])=[#7]\[#6]-[#6]-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#6]-[#6]-[#6](-[#8])=O)-[#7]-[#6]-1=O)-c1ccccc1)-[#6](-[#8])=O |r| Show InChI InChI=1S/C25H34N8O9/c26-25(27)28-10-4-7-14-21(38)31-15(8-9-19(36)37)22(39)33-20(13-5-2-1-3-6-13)23(40)32-16(24(41)42)11-17(34)29-12-18(35)30-14/h1-3,5-6,14-16,20H,4,7-12H2,(H,29,34)(H,30,35)(H,31,38)(H,32,40)(H,33,39)(H,36,37)(H,41,42)(H4,26,27,28)/t14-,15+,16-,20+/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t M£nchen Curated by ChEMBL					Assay Description Inhibition of fibronectin binding to human Integrin alpha5beta1 receptor by competitive ELISA				J Med Chem 56: 1509-19 (2013) Article DOI: 10.1021/jm301221x BindingDB Entry DOI: 10.7270/Q2FJ2J4B
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