Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein phosphatase non-receptor type 11' and Ligand = 'BDBM125934'   

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
Tyrosine-protein phosphatase non-receptor type 11 (Homo sapiens (Human))	BDBM125934 (Methyl 6-{4-[(2-Amino-6-methoxy-9H-purin-9-yl)meth...) Show SMILES CO[C@H]1O[C@H](Cn2cc(Cn3cnc4c(OC)nc(N)nc34)nn2)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1 Show InChI InChI=1S/C37H40N8O6/c1-46-35-30-34(40-37(38)41-35)44(24-39-30)18-28-19-45(43-42-28)20-29-31(48-21-25-12-6-3-7-13-25)32(49-22-26-14-8-4-9-15-26)33(36(47-2)51-29)50-23-27-16-10-5-11-17-27/h3-17,19,24,29,31-33,36H,18,20-23H2,1-2H3,(H2,38,40,41)/t29-,31+,32+,33-,36+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>8.00E+4	n/a	n/a	n/a	n/a	6.5	n/a
East China University of Science and Technology					Assay Description Enzymatic activity of enzyme was evaluated using pNPP assay. Briefly, a reaction mixture (100 µL) containing 50 mM MOPS (pH 6.5), 2 mM pNPP and recom...				Chem Biodivers 8: 2035-44 (2011) Article DOI: 10.1002/cbdv.201000242 BindingDB Entry DOI: 10.7270/Q2668BVX
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