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 = 'BDBM50362194'   

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))	BDBM50362194 (CHEMBL1938827) Show SMILES NS(=O)(=O)C(F)(F)c1cc2nc(CN(Cc3ccc(cc3)-c3csnn3)S(=O)(=O)c3ccc(OCC(O)=O)cc3)ccc2cc1Br Show InChI InChI=1S/C28H22BrF2N5O7S3/c29-24-11-19-5-6-20(33-25(19)12-23(24)28(30,31)46(32,41)42)14-36(13-17-1-3-18(4-2-17)26-16-44-35-34-26)45(39,40)22-9-7-21(8-10-22)43-15-27(37)38/h1-12,16H,13-15H2,(H,37,38)(H2,32,41,42)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a	n/a
M.S. University of Baroda Curated by ChEMBL					Assay Description Inhibition of PTP1B assessed as para-nitrophenyl phosphate catalyzed hydrolysis of para-nitrophenol by p-NPP assay				Bioorg Med Chem Lett 22: 1111-7 (2012) Article DOI: 10.1016/j.bmcl.2011.11.122 BindingDB Entry DOI: 10.7270/Q2ZS2X05
					More data for this Ligand-Target Pair