Compile Data Set for Download or QSAR

Found 26 hits Enz. Inhib. hit(s) with all data for entry = 50035431   

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 1 (Saccharomyces cerevisiae)	BDBM50366944 (Azovan Blue | Azovan sodium | EVANS BLUE) Show SMILES Cc1cc(ccc1N=Nc1ccc2c(cc(c(N)c2c1O)S([O-])(=O)=O)S([O-])(=O)=O)-c1ccc(N=Nc2ccc3c(cc(c(N)c3c2O)S([O-])(=O)=O)S([O-])(=O)=O)c(C)c1 |w:34.37,7.7| Show InChI InChI=1S/C34H28N6O14S4/c1-15-11-17(3-7-21(15)37-39-23-9-5-19-25(55(43,44)45)13-27(57(49,50)51)31(35)29(19)33(23)41)18-4-8-22(16(2)12-18)38-40-24-10-6-20-26(56(46,47)48)14-28(58(52,53)54)32(36)30(20)34(24)42/h3-14,41-42H,35-36H2,1-2H3,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)/p-4	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibitory activity against Saccharomyces cerevisiae Tyrosine phosphatase 1				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50366944 (Azovan Blue | Azovan sodium | EVANS BLUE) Show SMILES Cc1cc(ccc1N=Nc1ccc2c(cc(c(N)c2c1O)S([O-])(=O)=O)S([O-])(=O)=O)-c1ccc(N=Nc2ccc3c(cc(c(N)c3c2O)S([O-])(=O)=O)S([O-])(=O)=O)c(C)c1 |w:34.37,7.7| Show InChI InChI=1S/C34H28N6O14S4/c1-15-11-17(3-7-21(15)37-39-23-9-5-19-25(55(43,44)45)13-27(57(49,50)51)31(35)29(19)33(23)41)18-4-8-22(16(2)12-18)38-40-24-10-6-20-26(56(46,47)48)14-28(58(52,53)54)32(36)30(20)34(24)42/h3-14,41-42H,35-36H2,1-2H3,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)/p-4	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibition of human PTPase 1B				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50366943 (TRYPAN BLUE) Show SMILES Cc1cc(ccc1N=Nc1c(O)c2c(N)cc(cc2cc1S([O-])(=O)=O)S([O-])(=O)=O)-c1ccc(N=Nc2c(O)c3c(N)cc(cc3cc2S([O-])(=O)=O)S([O-])(=O)=O)c(C)c1 |w:8.9,33.35| Show InChI InChI=1S/C34H28N6O14S4/c1-15-7-17(3-5-25(15)37-39-31-27(57(49,50)51)11-19-9-21(55(43,44)45)13-23(35)29(19)33(31)41)18-4-6-26(16(2)8-18)38-40-32-28(58(52,53)54)12-20-10-22(56(46,47)48)14-24(36)30(20)34(32)42/h3-14,41-42H,35-36H2,1-2H3,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)/p-4	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibition of human PTPase 1B				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50143425 (5-{1-[3-Carboxy-4-oxo-cyclohexa-2,5-dien-(E)-ylide...) Show SMILES C\C(=C1\C=CC(=O)C(=C1)C(O)=O)c1ccc(O)c(c1)C(O)=O |c:3,7| Show InChI InChI=1S/C16H12O6/c1-8(9-2-4-13(17)11(6-9)15(19)20)10-3-5-14(18)12(7-10)16(21)22/h2-7,17H,1H3,(H,19,20)(H,21,22)/b10-8+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibition of human PTPase 1B				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase 1 (Saccharomyces cerevisiae)	BDBM50143421 (CHEMBL425511 | Di sodium; 4,5-Dihydroxy-7-sulfo-na...) Show SMILES Oc1cc(cc2cc(cc(O)c12)S([O-])(=O)=O)S([O-])(=O)=O Show InChI InChI=1S/C10H8O8S2/c11-8-3-6(19(13,14)15)1-5-2-7(20(16,17)18)4-9(12)10(5)8/h1-4,11-12H,(H,13,14,15)(H,16,17,18)/p-2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibitory activity against Saccharomyces cerevisiae Tyrosine phosphatase 1				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase 1 (Saccharomyces cerevisiae)	BDBM50366943 (TRYPAN BLUE) Show SMILES Cc1cc(ccc1N=Nc1c(O)c2c(N)cc(cc2cc1S([O-])(=O)=O)S([O-])(=O)=O)-c1ccc(N=Nc2c(O)c3c(N)cc(cc3cc2S([O-])(=O)=O)S([O-])(=O)=O)c(C)c1 |w:8.9,33.35| Show InChI InChI=1S/C34H28N6O14S4/c1-15-7-17(3-5-25(15)37-39-31-27(57(49,50)51)11-19-9-21(55(43,44)45)13-23(35)29(19)33(31)41)18-4-6-26(16(2)8-18)38-40-32-28(58(52,53)54)12-20-10-22(56(46,47)48)14-24(36)30(20)34(32)42/h3-14,41-42H,35-36H2,1-2H3,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)/p-4	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibitory activity against Saccharomyces cerevisiae Tyrosine phosphatase 1				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50143421 (CHEMBL425511 | Di sodium; 4,5-Dihydroxy-7-sulfo-na...) Show SMILES Oc1cc(cc2cc(cc(O)c12)S([O-])(=O)=O)S([O-])(=O)=O Show InChI InChI=1S/C10H8O8S2/c11-8-3-6(19(13,14)15)1-5-2-7(20(16,17)18)4-9(12)10(5)8/h1-4,11-12H,(H,13,14,15)(H,16,17,18)/p-2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibition of human PTPase 1B				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase 1 (Saccharomyces cerevisiae)	BDBM50404357 (CARMINE) Show SMILES Cc1c(C(O)=O)c(O)cc2C(=O)c3c(O)c(O)c([C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3C(=O)c12 Show InChI InChI=1S/C22H20O13/c1-4-8-5(2-6(24)9(4)22(33)34)13(25)10-11(15(8)27)16(28)12(18(30)17(10)29)21-20(32)19(31)14(26)7(3-23)35-21/h2,7,14,19-21,23-24,26,28-32H,3H2,1H3,(H,33,34)/t7-,14-,19+,20-,21-/m1/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibitory activity against Saccharomyces cerevisiae Tyrosine phosphatase 1				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50033731 ((R)-5,8-dihydroxy-2-(1-hydroxy-4-methylpent-3-enyl...) Show SMILES CC(C)C=CC(=O)c1cc(O)c2c(O)ccc(O)c2c1O |w:4.4| Show InChI InChI=1S/C16H16O5/c1-8(2)3-4-10(17)9-7-13(20)14-11(18)5-6-12(19)15(14)16(9)21/h3-8,18-21H,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibition of human PTPase 1B				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50404357 (CARMINE) Show SMILES Cc1c(C(O)=O)c(O)cc2C(=O)c3c(O)c(O)c([C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3C(=O)c12 Show InChI InChI=1S/C22H20O13/c1-4-8-5(2-6(24)9(4)22(33)34)13(25)10-11(15(8)27)16(28)12(18(30)17(10)29)21-20(32)19(31)14(26)7(3-23)35-21/h2,7,14,19-21,23-24,26,28-32H,3H2,1H3,(H,33,34)/t7-,14-,19+,20-,21-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibition of human PTPase 1B				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase 1 (Saccharomyces cerevisiae)	BDBM50143425 (5-{1-[3-Carboxy-4-oxo-cyclohexa-2,5-dien-(E)-ylide...) Show SMILES C\C(=C1\C=CC(=O)C(=C1)C(O)=O)c1ccc(O)c(c1)C(O)=O |c:3,7| Show InChI InChI=1S/C16H12O6/c1-8(9-2-4-13(17)11(6-9)15(19)20)10-3-5-14(18)12(7-10)16(21)22/h2-7,17H,1H3,(H,19,20)(H,21,22)/b10-8+	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibitory activity against Saccharomyces cerevisiae Tyrosine phosphatase 1				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50143429 (CHEMBL174821 | Di sodium; 6-Hydroxy-5-(2-methoxy-5...) Show SMILES COc1cc(c(C)cc1N=Nc1c(O)ccc2cc(ccc12)S([O-])(=O)=O)S([O-])(=O)=O |w:10.11| Show InChI InChI=1S/C18H16N2O8S2/c1-10-7-14(16(28-2)9-17(10)30(25,26)27)19-20-18-13-5-4-12(29(22,23)24)8-11(13)3-6-15(18)21/h3-9,21H,1-2H3,(H,22,23,24)(H,25,26,27)/p-2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibition of human PTPase 1B				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50143419 (CHEMBL175336 | Sodium; 3,4-dihydroxy-9,10-dioxo-9,...) Show SMILES Oc1c(O)c2C(=O)c3ccccc3C(=O)c2cc1S([O-])(=O)=O Show InChI InChI=1S/C14H8O7S/c15-11-6-3-1-2-4-7(6)12(16)10-8(11)5-9(22(19,20)21)13(17)14(10)18/h1-5,17-18H,(H,19,20,21)/p-1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibition of human PTPase 1B				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase 1 (Saccharomyces cerevisiae)	BDBM50143419 (CHEMBL175336 | Sodium; 3,4-dihydroxy-9,10-dioxo-9,...) Show SMILES Oc1c(O)c2C(=O)c3ccccc3C(=O)c2cc1S([O-])(=O)=O Show InChI InChI=1S/C14H8O7S/c15-11-6-3-1-2-4-7(6)12(16)10-8(11)5-9(22(19,20)21)13(17)14(10)18/h1-5,17-18H,(H,19,20,21)/p-1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	4.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibitory activity against Saccharomyces cerevisiae Tyrosine phosphatase 1				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase 1 (Saccharomyces cerevisiae)	BDBM50033731 ((R)-5,8-dihydroxy-2-(1-hydroxy-4-methylpent-3-enyl...) Show SMILES CC(C)C=CC(=O)c1cc(O)c2c(O)ccc(O)c2c1O |w:4.4| Show InChI InChI=1S/C16H16O5/c1-8(2)3-4-10(17)9-7-13(20)14-11(18)5-6-12(19)15(14)16(9)21/h3-8,18-21H,1-2H3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibitory activity against Saccharomyces cerevisiae Tyrosine phosphatase 1				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase 1 (Saccharomyces cerevisiae)	BDBM50143418 (7-Hydroxy-8-(2-hydroxy-4-sulfo-naphthalen-1-ylazo)...) Show SMILES Oc1cc(c2ccccc2c1N=Nc1c(O)c(cc2cc(cc(c12)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O |w:11.12| Show InChI InChI=1S/C20H14N2O14S4/c23-13-8-14(38(28,29)30)11-3-1-2-4-12(11)18(13)21-22-19-17-9(6-16(20(19)24)40(34,35)36)5-10(37(25,26)27)7-15(17)39(31,32)33/h1-8,23-24H,(H,25,26,27)(H,28,29,30)(H,31,32,33)(H,34,35,36)/p-4	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.10E+5	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibitory activity against Saccharomyces cerevisiae Tyrosine phosphatase 1				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase 1 (Saccharomyces cerevisiae)	BDBM50143420 (CHEMBL3144822 | Sodium; 3-hydroxy-4-(5-hydroxy-3-m...) Show SMILES Cc1[nH]n(-c2ccccc2)c(=O)c1N=Nc1c(O)cc(c2ccccc12)S(O)(=O)=O Show InChI InChI=1S/C20H16N4O5S/c1-12-18(20(26)24(23-12)13-7-3-2-4-8-13)21-22-19-15-10-6-5-9-14(15)17(11-16(19)25)30(27,28)29/h2-11,23,25H,1H3,(H,27,28,29)/p-1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+5	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibitory activity against Saccharomyces cerevisiae Tyrosine phosphatase 1				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50143420 (CHEMBL3144822 | Sodium; 3-hydroxy-4-(5-hydroxy-3-m...) Show SMILES Cc1[nH]n(-c2ccccc2)c(=O)c1N=Nc1c(O)cc(c2ccccc12)S(O)(=O)=O Show InChI InChI=1S/C20H16N4O5S/c1-12-18(20(26)24(23-12)13-7-3-2-4-8-13)21-22-19-15-10-6-5-9-14(15)17(11-16(19)25)30(27,28)29/h2-11,23,25H,1H3,(H,27,28,29)/p-1	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	1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibition of human PTPase 1B				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50143423 (CHEMBL176350 | Sodium; 2-hydroxy-5-(4-nitro-phenyl...) Show SMILES Oc1ccc(cc1C([O-])=O)N=Nc1ccc(cc1)[N+]([O-])=O |w:10.10| Show InChI InChI=1S/C13H9N3O5/c17-12-6-3-9(7-11(12)13(18)19)15-14-8-1-4-10(5-2-8)16(20)21/h1-7,17H,(H,18,19)/p-1	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	2.10E+5	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibition of human PTPase 1B				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM38549 (2-[2-[4-[(4-chlorophenyl)-phenyl-methyl]piperazino...) Show SMILES OC(=O)c1cc2ccccc2c(Cc2c(O)c(cc3ccccc23)C(O)=O)c1O Show InChI InChI=1S/C23H16O6/c24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29/h1-10,24-25H,11H2,(H,26,27)(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	3.10E+5	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibition of human PTPase 1B				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase 1 (Saccharomyces cerevisiae)	BDBM50143429 (CHEMBL174821 | Di sodium; 6-Hydroxy-5-(2-methoxy-5...) Show SMILES COc1cc(c(C)cc1N=Nc1c(O)ccc2cc(ccc12)S([O-])(=O)=O)S([O-])(=O)=O |w:10.11| Show InChI InChI=1S/C18H16N2O8S2/c1-10-7-14(16(28-2)9-17(10)30(25,26)27)19-20-18-13-5-4-12(29(22,23)24)8-11(13)3-6-15(18)21/h3-9,21H,1-2H3,(H,22,23,24)(H,25,26,27)/p-2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.10E+5	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibitory activity against Saccharomyces cerevisiae Tyrosine phosphatase 1				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50143418 (7-Hydroxy-8-(2-hydroxy-4-sulfo-naphthalen-1-ylazo)...) Show SMILES Oc1cc(c2ccccc2c1N=Nc1c(O)c(cc2cc(cc(c12)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O |w:11.12| Show InChI InChI=1S/C20H14N2O14S4/c23-13-8-14(38(28,29)30)11-3-1-2-4-12(11)18(13)21-22-19-17-9(6-16(20(19)24)40(34,35)36)5-10(37(25,26)27)7-15(17)39(31,32)33/h1-8,23-24H,(H,25,26,27)(H,28,29,30)(H,31,32,33)(H,34,35,36)/p-4	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	4.60E+5	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibition of human PTPase 1B				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50143424 (2-(3-hydroxy-6-oxo-6H-xanthen-9-yl)benzoic acid | ...) Show SMILES OC(=O)c1ccccc1-c1c2ccc(O)cc2oc2cc(=O)ccc12 |(-6.39,-28.75,;-5.64,-30.09,;-6.42,-31.42,;-4.1,-30.1,;-4.09,-28.56,;-2.74,-27.79,;-1.41,-28.57,;-1.42,-30.11,;-2.76,-30.87,;-2.77,-32.41,;-1.43,-33.19,;-.1,-32.42,;1.23,-33.2,;1.22,-34.74,;2.54,-35.52,;-.12,-35.5,;-1.44,-34.73,;-2.78,-35.49,;-4.11,-34.72,;-5.43,-35.48,;-6.76,-34.72,;-8.09,-35.49,;-6.76,-33.18,;-5.43,-32.4,;-4.1,-33.18,)| Show InChI InChI=1S/C20H12O5/c21-11-5-7-15-17(9-11)25-18-10-12(22)6-8-16(18)19(15)13-3-1-2-4-14(13)20(23)24/h1-10,21H,(H,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	6.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibition of human PTPase 1B				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase 1 (Saccharomyces cerevisiae)	BDBM50143423 (CHEMBL176350 | Sodium; 2-hydroxy-5-(4-nitro-phenyl...) Show SMILES Oc1ccc(cc1C([O-])=O)N=Nc1ccc(cc1)[N+]([O-])=O |w:10.10| Show InChI InChI=1S/C13H9N3O5/c17-12-6-3-9(7-11(12)13(18)19)15-14-8-1-4-10(5-2-8)16(20)21/h1-7,17H,(H,18,19)/p-1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.30E+5	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibitory activity against Saccharomyces cerevisiae Tyrosine phosphatase 1				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase 1 (Saccharomyces cerevisiae)	BDBM50143424 (2-(3-hydroxy-6-oxo-6H-xanthen-9-yl)benzoic acid | ...) Show SMILES OC(=O)c1ccccc1-c1c2ccc(O)cc2oc2cc(=O)ccc12 |(-6.39,-28.75,;-5.64,-30.09,;-6.42,-31.42,;-4.1,-30.1,;-4.09,-28.56,;-2.74,-27.79,;-1.41,-28.57,;-1.42,-30.11,;-2.76,-30.87,;-2.77,-32.41,;-1.43,-33.19,;-.1,-32.42,;1.23,-33.2,;1.22,-34.74,;2.54,-35.52,;-.12,-35.5,;-1.44,-34.73,;-2.78,-35.49,;-4.11,-34.72,;-5.43,-35.48,;-6.76,-34.72,;-8.09,-35.49,;-6.76,-33.18,;-5.43,-32.4,;-4.1,-33.18,)| Show InChI InChI=1S/C20H12O5/c21-11-5-7-15-17(9-11)25-18-10-12(22)6-8-16(18)19(15)13-3-1-2-4-14(13)20(23)24/h1-10,21H,(H,23,24)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	8.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibitory activity against Saccharomyces cerevisiae Tyrosine phosphatase 1				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase 1 (Saccharomyces cerevisiae)	BDBM38549 (2-[2-[4-[(4-chlorophenyl)-phenyl-methyl]piperazino...) Show SMILES OC(=O)c1cc2ccccc2c(Cc2c(O)c(cc3ccccc23)C(O)=O)c1O Show InChI InChI=1S/C23H16O6/c24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29/h1-10,24-25H,11H2,(H,26,27)(H,28,29)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Inha University Curated by ChEMBL					Assay Description Inhibitory activity against Saccharomyces cerevisiae Tyrosine phosphatase 1				Bioorg Med Chem Lett 14: 1923-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.079 BindingDB Entry DOI: 10.7270/Q2JS9R01
					More data for this Ligand-Target Pair