Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-IIb/beta-3' and Ligand = 'BDBM50421440'   

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))	BDBM50421440 (CHEMBL355201) Show SMILES CCCCNC(=N)c1ccc(C(=O)N[C@H](CC)C(C)(C)C(=O)N2CCC(CC(O)=O)CC2)c(F)c1 Show InChI InChI=1S/C26H39FN4O4/c1-5-7-12-29-23(28)18-8-9-19(20(27)16-18)24(34)30-21(6-2)26(3,4)25(35)31-13-10-17(11-14-31)15-22(32)33/h8-9,16-17,21H,5-7,10-15H2,1-4H3,(H2,28,29)(H,30,34)(H,32,33)/t21-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	501	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description The compound was tested for its inhibitory activity against platelet aggregation				Bioorg Med Chem Lett 10: 859-63 (2000) BindingDB Entry DOI: 10.7270/Q2W95BFN
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