Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein phosphatase non-receptor type 1' and Ligand = 'BDBM50171100'   

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))	BDBM50171100 (CHEMBL198882 | {4-[[4-(Difluoro-phosphono-methyl)-...) Show SMILES OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O Show InChI InChI=1S/C25H22F2N3O8PS2/c26-25(27,39(33,34)35)20-7-3-18(4-8-20)14-30(13-17-1-5-19(6-2-17)23-16-40-29-28-23)41(36,37)22-11-9-21(10-12-22)38-15-24(31)32/h1-12,16H,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	56	n/a	n/a	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
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50171100 (CHEMBL198882 | {4-[[4-(Difluoro-phosphono-methyl)-...) Show SMILES OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O Show InChI InChI=1S/C25H22F2N3O8PS2/c26-25(27,39(33,34)35)20-7-3-18(4-8-20)14-30(13-17-1-5-19(6-2-17)23-16-40-29-28-23)41(36,37)22-11-9-21(10-12-22)38-15-24(31)32/h1-12,16H,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	74	n/a	n/a	n/a	n/a	n/a	n/a
Affymax, Inc. Curated by ChEMBL					Assay Description Inhibition of PTP1B				Bioorg Med Chem Lett 18: 2719-24 (2008) Article DOI: 10.1016/j.bmcl.2008.03.007 BindingDB Entry DOI: 10.7270/Q23J3DTX
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50171100 (CHEMBL198882 | {4-[[4-(Difluoro-phosphono-methyl)-...) Show SMILES OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O Show InChI InChI=1S/C25H22F2N3O8PS2/c26-25(27,39(33,34)35)20-7-3-18(4-8-20)14-30(13-17-1-5-19(6-2-17)23-16-40-29-28-23)41(36,37)22-11-9-21(10-12-22)38-15-24(31)32/h1-12,16H,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	74	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
					More data for this Ligand-Target Pair