Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-IIb/beta-3' and Ligand = 'BDBM50111422'   

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))	BDBM50111422 (5-[(2-Pyridin-4-yl-2,8-diaza-spiro[4.5]decane-8-ca...) Show SMILES OC(=O)CCCCNC(=O)N1CCC2(CCN(C2)c2ccncc2)CC1 Show InChI InChI=1S/C19H28N4O3/c24-17(25)3-1-2-9-21-18(26)22-12-6-19(7-13-22)8-14-23(15-19)16-4-10-20-11-5-16/h4-5,10-11H,1-3,6-9,12-15H2,(H,21,26)(H,24,25)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.19E+4	n/a	n/a	n/a	n/a	n/a	n/a
COR Therapeutics, Inc. Curated by ChEMBL					Assay Description In vitro activity to block the binding of fibrinogen to purified human fibrinogen receptor.				Bioorg Med Chem Lett 12: 1103-7 (2002) BindingDB Entry DOI: 10.7270/Q2H131BN
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