Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-IIb/beta-3' and Ligand = 'BDBM50185461'   

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-IIb/beta-3 (Homo sapiens (Human))	BDBM50185461 (3-(benzo[d][1,3]dioxol-5-yl)-4-(1-methyl-5-(3-(3,4...) Show SMILES Cn1nc(CC(CC(O)=O)c2ccc3OCOc3c2)cc1OCCCN=C1CCCCN1 |w:25.27| Show InChI InChI=1S/C23H30N4O5/c1-27-22(30-10-4-9-25-21-5-2-3-8-24-21)14-18(26-27)11-17(13-23(28)29)16-6-7-19-20(12-16)32-15-31-19/h6-7,12,14,17H,2-5,8-11,13,15H2,1H3,(H,24,25)(H,28,29)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	16.2	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of alpha2bbeta3 integrin by SPRA				Bioorg Med Chem Lett 16: 3156-61 (2006) Article DOI: 10.1016/j.bmcl.2006.03.045 BindingDB Entry DOI: 10.7270/Q29023CB
					More data for this Ligand-Target Pair