Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein phosphatase non-receptor type 1' and Ligand = 'BDBM50171111'   

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 1 (Homo sapiens (Human))	BDBM50171111 (CHEMBL199124 | [(4-{[Benzyl-(2-nitro-benzenesulfon...) Show SMILES OP(O)(=O)C(F)(F)c1ccc(CN(Cc2ccccc2)S(=O)(=O)c2ccccc2[N+]([O-])=O)cc1 Show InChI InChI=1S/C21H19F2N2O7PS/c22-21(23,33(28,29)30)18-12-10-17(11-13-18)15-24(14-16-6-2-1-3-7-16)34(31,32)20-9-5-4-8-19(20)25(26)27/h1-13H,14-15H2,(H2,28,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Affymax, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against protein tyrosine phosphatase 1B using O-methyl fluorescein monophosphate				Bioorg Med Chem Lett 15: 4336-41 (2005) Article DOI: 10.1016/j.bmcl.2005.06.061 BindingDB Entry DOI: 10.7270/Q2M61JSK
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