Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-IIb/beta-3' and Ligand = 'BDBM228636'   

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))	BDBM228636 (US9345793, 17 | US9744252, Example 17) Show SMILES OC(=O)C[C@H](NC(=O)[C@@H]1CCCN(C1)C(=O)CCC1CCNCC1)c1cc(F)cc(c1)-c1ccc(OCCF)cc1 |r| Show InChI InChI=1S/C31H39F2N3O5/c32-11-15-41-27-6-4-22(5-7-27)24-16-25(18-26(33)17-24)28(19-30(38)39)35-31(40)23-2-1-14-36(20-23)29(37)8-3-21-9-12-34-13-10-21/h4-7,16-18,21,23,28,34H,1-3,8-15,19-20H2,(H,35,40)(H,38,39)/t23-,28+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	2
PIRAMAL IMAGING SA US Patent					Assay Description The GPIIb/IIIa receptor was immobilized 48 hours at least (100 μL per well, 48 to maximum 96 hours) on a 96-well solid plate (Immuno Plate MaxiSor...				US Patent US9345793 (2016) BindingDB Entry DOI: 10.7270/Q22806GR
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