Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein phosphatase non-receptor type 2' and Ligand = 'BDBM50391124'   

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 2 (Homo sapiens (Human))	BDBM50391124 (CHEMBL2087682) Show SMILES CCOS(=O)(=O)\C=C\c1ccc(OCCCCNc2nc(c(C)s2)-c2ccccc2)c(OC)c1 Show InChI InChI=1S/C25H30N2O5S2/c1-4-32-34(28,29)17-14-20-12-13-22(23(18-20)30-3)31-16-9-8-15-26-25-27-24(19(2)33-25)21-10-6-5-7-11-21/h5-7,10-14,17-18H,4,8-9,15-16H2,1-3H3,(H,26,27)/b17-14+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shanghai Jiao Tong University Curated by ChEMBL					Assay Description Inhibition of human recombinant TCPTP assessed as inhibition of hydrolysis of p-nitrophenol after 10 mins by spectrophotometry				Eur J Med Chem 57: 10-20 (2012) Article DOI: 10.1016/j.ejmech.2012.09.015 BindingDB Entry DOI: 10.7270/Q2HX1DRS
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