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 = 'BDBM50171108'   

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))	BDBM50171108 ((4-{Benzyl-[4-(difluoro-phosphono-methyl)-benzyl]-...) Show SMILES OC(=O)COc1ccc(cc1C(F)(F)F)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O Show InChI InChI=1S/C24H21F5NO8PS/c25-23(26,27)20-12-19(10-11-21(20)38-15-22(31)32)40(36,37)30(13-16-4-2-1-3-5-16)14-17-6-8-18(9-7-17)24(28,29)39(33,34)35/h1-12H,13-15H2,(H,31,32)(H2,33,34,35)	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	4.00E+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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