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PubMed code 12113814

Compile data set for download or QSAR
Found 60 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115725
PNG
(3-(1-Indol-1-yl-3,4-dioxo-3,4-dihydro-naphthalen-2...)
Show SMILES CCOC(=O)CCC1=C(c2ccccc2C(=O)C1=O)n1ccc2ccccc12
Show InChI InChI=1S/C23H19NO4/c1-2-28-20(25)12-11-18-21(24-14-13-15-7-3-6-10-19(15)24)16-8-4-5-9-17(16)22(26)23(18)27/h3-10,13-14H,2,11-12H2,1H3
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n/an/a 270n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of human Protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP)


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115722
PNG
(4-Cyclohexyl-[1,2]naphthoquinone | CHEMBL58737)
Show SMILES O=C1C=C(C2CCCCC2)c2ccccc2C1=O
Show InChI InChI=1S/C16H16O2/c17-15-10-14(11-6-2-1-3-7-11)12-8-4-5-9-13(12)16(15)18/h4-5,8-11H,1-3,6-7H2
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n/an/a 320n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115756
PNG
(3-(5,6-Dioxo-8-phenyl-5,6-dihydro-naphthalen-2-yl)...)
Show SMILES COC(=O)CCc1ccc2C(=O)C(=O)C=C(c3ccccc3)c2c1
Show InChI InChI=1S/C20H16O4/c1-24-19(22)10-8-13-7-9-15-17(11-13)16(12-18(21)20(15)23)14-5-3-2-4-6-14/h2-7,9,11-12H,8,10H2,1H3
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n/an/a 330n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of human Protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP)


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115733
PNG
(3-(3,4-Dioxo-1-phenyl-3,4-dihydro-naphthalen-2-yl)...)
Show SMILES CCOC(=O)CCC1=C(c2ccccc2)c2ccccc2C(=O)C1=O
Show InChI InChI=1S/C21H18O4/c1-2-25-18(22)13-12-17-19(14-8-4-3-5-9-14)15-10-6-7-11-16(15)20(23)21(17)24/h3-11H,2,12-13H2,1H3
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n/an/a 430n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of human Protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP)


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115766
PNG
(4-(4-Hydroxy-phenyl)-[1,2]naphthoquinone | CHEMBL5...)
Show SMILES Oc1ccc(cc1)C1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C16H10O3/c17-11-7-5-10(6-8-11)14-9-15(18)16(19)13-4-2-1-3-12(13)14/h1-9,17H
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n/an/a 440n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115760
PNG
(4-(2,5-Difluoro-phenyl)-[1,2]naphthoquinone | CHEM...)
Show SMILES Fc1ccc(F)c(c1)C1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C16H8F2O2/c17-9-5-6-14(18)13(7-9)12-8-15(19)16(20)11-4-2-1-3-10(11)12/h1-8H
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n/an/a 500n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115721
PNG
(3-(3,4-Dioxo-1-phenyl-3,4-dihydro-naphthalen-2-yl)...)
Show SMILES CCN(CC)C(=O)CCC1=C(c2ccccc2)c2ccccc2C(=O)C1=O
Show InChI InChI=1S/C23H23NO3/c1-3-24(4-2)20(25)15-14-19-21(16-10-6-5-7-11-16)17-12-8-9-13-18(17)22(26)23(19)27/h5-13H,3-4,14-15H2,1-2H3
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n/an/a 610n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of human Protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP)


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115739
PNG
(CHEMBL56948 | [4-(1-Indol-1-yl-3,4-dioxo-3,4-dihyd...)
Show SMILES CC(C)(C)OC(=O)COc1ccc(CC2=C(c3ccccc3C(=O)C2=O)n2ccc3ccccc23)cc1
Show InChI InChI=1S/C31H27NO5/c1-31(2,3)37-27(33)19-36-22-14-12-20(13-15-22)18-25-28(32-17-16-21-8-4-7-11-26(21)32)23-9-5-6-10-24(23)29(34)30(25)35/h4-17H,18-19H2,1-3H3
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n/an/a 650n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of human Protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP)


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115740
PNG
((7,8-Dioxo-5-phenyl-7,8-dihydro-naphthalen-1-yl)-c...)
Show SMILES CCOC(=O)Nc1cccc2C(=CC(=O)C(=O)c12)c1ccccc1
Show InChI InChI=1S/C19H15NO4/c1-2-24-19(23)20-15-10-6-9-13-14(12-7-4-3-5-8-12)11-16(21)18(22)17(13)15/h3-11H,2H2,1H3,(H,20,23)
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n/an/a 650n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115746
PNG
(3-[7-(2-Methoxycarbonyl-ethyl)-3,4-dioxo-1-phenyl-...)
Show SMILES COC(=O)CCC1=C(c2ccccc2)c2cc(CCC(=O)OC)ccc2C(=O)C1=O
Show InChI InChI=1S/C24H22O6/c1-29-20(25)12-9-15-8-10-17-19(14-15)22(16-6-4-3-5-7-16)18(24(28)23(17)27)11-13-21(26)30-2/h3-8,10,14H,9,11-13H2,1-2H3
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n/an/a 680n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of human Protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP)


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Tyrosine-Protein Phosphatase (CD45)


(Homo sapiens (Human))
BDBM50099778
PNG
(4-Phenyl-[1,2]naphthoquinone | CHEMBL51447)
Show SMILES O=C1C=C(c2ccccc2)c2ccccc2C1=O
Show InChI InChI=1S/C16H10O2/c17-15-10-14(11-6-2-1-3-7-11)12-8-4-5-9-13(12)16(15)18/h1-10H
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n/an/a 840n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity of the compound against recombinant human CD45 using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50099778
PNG
(4-Phenyl-[1,2]naphthoquinone | CHEMBL51447)
Show SMILES O=C1C=C(c2ccccc2)c2ccccc2C1=O
Show InChI InChI=1S/C16H10O2/c17-15-10-14(11-6-2-1-3-7-11)12-8-4-5-9-13(12)16(15)18/h1-10H
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n/an/a 860n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115755
PNG
(3-(8-Indol-1-yl-5,6-dioxo-5,6-dihydro-naphthalen-2...)
Show SMILES COC(=O)CCc1ccc2C(=O)C(=O)C=C(c2c1)n1ccc2ccccc12
Show InChI InChI=1S/C22H17NO4/c1-27-21(25)9-7-14-6-8-16-17(12-14)19(13-20(24)22(16)26)23-11-10-15-4-2-3-5-18(15)23/h2-6,8,10-13H,7,9H2,1H3
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n/an/a 920n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of human Protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP)


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115763
PNG
(7-Pentyloxy-4-phenyl-[1,2]naphthoquinone | CHEMBL5...)
Show SMILES CCCCCOc1ccc2C(=CC(=O)C(=O)c2c1)c1ccccc1
Show InChI InChI=1S/C21H20O3/c1-2-3-7-12-24-16-10-11-17-18(15-8-5-4-6-9-15)14-20(22)21(23)19(17)13-16/h4-6,8-11,13-14H,2-3,7,12H2,1H3
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n/an/a 920n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115751
PNG
(3-[1-Indol-1-yl-6-(2-methoxycarbonyl-ethyl)-3,4-di...)
Show SMILES COC(=O)CCC1=C(c2ccc(CCC(=O)OC)cc2C(=O)C1=O)n1ccc2ccccc12
Show InChI InChI=1S/C26H23NO6/c1-32-22(28)11-8-16-7-9-18-20(15-16)26(31)25(30)19(10-12-23(29)33-2)24(18)27-14-13-17-5-3-4-6-21(17)27/h3-7,9,13-15H,8,10-12H2,1-2H3
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n/an/a 940n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of human Protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP)


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115761
PNG
(4-[2-(3,4-Dioxo-1-phenyl-3,4-dihydro-naphthalen-2-...)
Show SMILES CCOC(=O)c1ccc(CCC2=C(c3ccccc3)c3ccccc3C(=O)C2=O)cc1
Show InChI InChI=1S/C27H22O4/c1-2-31-27(30)20-15-12-18(13-16-20)14-17-23-24(19-8-4-3-5-9-19)21-10-6-7-11-22(21)25(28)26(23)29/h3-13,15-16H,2,14,17H2,1H3
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n/an/a 1.01E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of human Protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP)


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115728
PNG
(CHEMBL57841 | [4-(1-Indol-1-yl-3,4-dioxo-3,4-dihyd...)
Show SMILES OC(=O)COc1ccc(CC2=C(c3ccccc3C(=O)C2=O)n2ccc3ccccc23)cc1
Show InChI InChI=1S/C27H19NO5/c29-24(30)16-33-19-11-9-17(10-12-19)15-22-25(28-14-13-18-5-1-4-8-23(18)28)20-6-2-3-7-21(20)26(31)27(22)32/h1-14H,15-16H2,(H,29,30)
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n/an/a 1.01E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of human Protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP)


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115729
PNG
(CHEMBL292843 | [4-(3,4-Dioxo-3,4-dihydro-naphthale...)
Show SMILES CCOC(=O)COc1ccc(cc1)C1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C20H16O5/c1-2-24-19(22)12-25-14-9-7-13(8-10-14)17-11-18(21)20(23)16-6-4-3-5-15(16)17/h3-11H,2,12H2,1H3
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n/an/a 1.07E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115737
PNG
(4-(1H-Indol-3-yl)-[1,2]naphthoquinone | CHEMBL6070...)
Show SMILES O=C1C=C(c2c[nH]c3ccccc23)c2ccccc2C1=O
Show InChI InChI=1S/C18H11NO2/c20-17-9-14(11-5-1-2-7-13(11)18(17)21)15-10-19-16-8-4-3-6-12(15)16/h1-10,19H
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n/an/a 1.13E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115727
PNG
(4-(2-Nitro-phenyl)-[1,2]naphthoquinone | CHEMBL592...)
Show SMILES [O-][N+](=O)c1ccccc1C1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C16H9NO4/c18-15-9-13(10-5-1-2-7-12(10)16(15)19)11-6-3-4-8-14(11)17(20)21/h1-9H
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n/an/a 1.17E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115744
PNG
((7,8-Dioxo-5-phenyl-7,8-dihydro-naphthalen-1-yl)-c...)
Show SMILES O=C(Nc1cccc2C(=CC(=O)C(=O)c12)c1ccccc1)OCc1ccccc1
Show InChI InChI=1S/C24H17NO4/c26-21-14-19(17-10-5-2-6-11-17)18-12-7-13-20(22(18)23(21)27)25-24(28)29-15-16-8-3-1-4-9-16/h1-14H,15H2,(H,25,28)
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n/an/a 1.34E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115765
PNG
(4-Benzyl-[1,2]naphthoquinone | CHEMBL292386)
Show SMILES O=C1C=C(Cc2ccccc2)c2ccccc2C1=O
Show InChI InChI=1S/C17H12O2/c18-16-11-13(10-12-6-2-1-3-7-12)14-8-4-5-9-15(14)17(16)19/h1-9,11H,10H2
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n/an/a 1.42E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115735
PNG
(CHEMBL58354 | [4-(3,4-Dioxo-1-phenyl-3,4-dihydro-n...)
Show SMILES CC(C)(C)OC(=O)COc1ccc(CC2=C(c3ccccc3)c3ccccc3C(=O)C2=O)cc1
Show InChI InChI=1S/C29H26O5/c1-29(2,3)34-25(30)18-33-21-15-13-19(14-16-21)17-24-26(20-9-5-4-6-10-20)22-11-7-8-12-23(22)27(31)28(24)32/h4-16H,17-18H2,1-3H3
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n/an/a 1.48E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of human Protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP)


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115748
PNG
(CHEMBL301436 | [4-(3,4-Dioxo-1-phenyl-3,4-dihydro-...)
Show SMILES OC(=O)COc1ccc(CC2=C(c3ccccc3)c3ccccc3C(=O)C2=O)cc1
Show InChI InChI=1S/C25H18O5/c26-22(27)15-30-18-12-10-16(11-13-18)14-21-23(17-6-2-1-3-7-17)19-8-4-5-9-20(19)24(28)25(21)29/h1-13H,14-15H2,(H,26,27)
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n/an/a 1.54E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of human Protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP)


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115731
PNG
(4-(3,4-Dioxo-3,4-dihydro-naphthalen-1-yl)-benzoic ...)
Show SMILES COC(=O)c1ccc(cc1)C1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C18H12O4/c1-22-18(21)12-8-6-11(7-9-12)15-10-16(19)17(20)14-5-3-2-4-13(14)15/h2-10H,1H3
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n/an/a 1.54E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115738
PNG
(4-(2-Hydroxy-phenyl)-[1,2]naphthoquinone | CHEMBL6...)
Show SMILES Oc1ccccc1C1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C16H10O3/c17-14-8-4-3-6-11(14)13-9-15(18)16(19)12-7-2-1-5-10(12)13/h1-9,17H
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n/an/a 1.60E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM22851
PNG
(1,2-Dione-Based Compound, 8 | 1,2-dihydronaphthale...)
Show SMILES O=C1C=Cc2ccccc2C1=O
Show InChI InChI=1S/C10H6O2/c11-9-6-5-7-3-1-2-4-8(7)10(9)12/h1-6H
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n/an/a 1.64E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of human Protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP)


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Tyrosine-Protein Phosphatase (CD45)


(Homo sapiens (Human))
BDBM50115731
PNG
(4-(3,4-Dioxo-3,4-dihydro-naphthalen-1-yl)-benzoic ...)
Show SMILES COC(=O)c1ccc(cc1)C1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C18H12O4/c1-22-18(21)12-8-6-11(7-9-12)15-10-16(19)17(20)14-5-3-2-4-13(14)15/h2-10H,1H3
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n/an/a 1.65E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity of the compound against recombinant human CD45 using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Dual specificity phosphatase Cdc25B


(Homo sapiens (Human))
BDBM50115737
PNG
(4-(1H-Indol-3-yl)-[1,2]naphthoquinone | CHEMBL6070...)
Show SMILES O=C1C=C(c2c[nH]c3ccccc23)c2ccccc2C1=O
Show InChI InChI=1S/C18H11NO2/c20-17-9-14(11-5-1-2-7-13(11)18(17)21)15-10-19-16-8-4-3-6-12(15)16/h1-10,19H
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n/an/a 1.95E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity of the compound against recombinant human Cdc25B using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115743
PNG
(7-Methoxy-4-phenyl-[1,2]naphthoquinone | CHEMBL587...)
Show SMILES COc1ccc2C(=CC(=O)C(=O)c2c1)c1ccccc1
Show InChI InChI=1S/C17H12O3/c1-20-12-7-8-13-14(11-5-3-2-4-6-11)10-16(18)17(19)15(13)9-12/h2-10H,1H3
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n/an/a 2.04E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115764
PNG
(2-(5-Indol-1-yl-7,8-dioxo-7,8-dihydro-naphthalen-2...)
Show SMILES OC(=O)C(Cc1ccccc1)Oc1ccc2C(=CC(=O)C(=O)c2c1)n1ccc2ccccc12
Show InChI InChI=1S/C27H19NO5/c29-24-16-23(28-13-12-18-8-4-5-9-22(18)28)20-11-10-19(15-21(20)26(24)30)33-25(27(31)32)14-17-6-2-1-3-7-17/h1-13,15-16,25H,14H2,(H,31,32)
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n/an/a 2.07E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Dual specificity phosphatase Cdc25B


(Homo sapiens (Human))
BDBM50115731
PNG
(4-(3,4-Dioxo-3,4-dihydro-naphthalen-1-yl)-benzoic ...)
Show SMILES COC(=O)c1ccc(cc1)C1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C18H12O4/c1-22-18(21)12-8-6-11(7-9-12)15-10-16(19)17(20)14-5-3-2-4-13(14)15/h2-10H,1H3
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n/an/a 2.13E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity of the compound against recombinant human Cdc25B using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115749
PNG
(CHEMBL57036 | [2-(3,4-Dioxo-3,4-dihydro-naphthalen...)
Show SMILES CCOC(=O)COc1ccccc1C1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C20H16O5/c1-2-24-19(22)12-25-18-10-6-5-8-14(18)16-11-17(21)20(23)15-9-4-3-7-13(15)16/h3-11H,2,12H2,1H3
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n/an/a 2.15E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115758
PNG
(CHEMBL59240 | [1,1']Binaphthalenyl-3,4-dione)
Show SMILES O=C1C=C(c2ccccc2C1=O)c1cccc2ccccc12
Show InChI InChI=1S/C20H12O2/c21-19-12-18(16-9-3-4-10-17(16)20(19)22)15-11-5-7-13-6-1-2-8-14(13)15/h1-12H
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n/an/a 2.15E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115757
PNG
((7,8-Dioxo-5-phenyl-7,8-dihydro-naphthalen-2-yl)-c...)
Show SMILES O=C(Nc1ccc2C(=CC(=O)C(=O)c2c1)c1ccccc1)OCc1ccccc1
Show InChI InChI=1S/C24H17NO4/c26-22-14-20(17-9-5-2-6-10-17)19-12-11-18(13-21(19)23(22)27)25-24(28)29-15-16-7-3-1-4-8-16/h1-14H,15H2,(H,25,28)
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n/an/a 2.25E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein phosphatase F (LAR)


(Homo sapiens (Human))
BDBM50099778
PNG
(4-Phenyl-[1,2]naphthoquinone | CHEMBL51447)
Show SMILES O=C1C=C(c2ccccc2)c2ccccc2C1=O
Show InChI InChI=1S/C16H10O2/c17-15-10-14(11-6-2-1-3-7-11)12-8-4-5-9-13(12)16(15)18/h1-10H
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n/an/a 2.49E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity of the compound against recombinant human LAR using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115762
PNG
(2-(7,8-Dioxo-5-phenyl-7,8-dihydro-naphthalen-2-ylo...)
Show SMILES COC(=O)C(Cc1ccccc1)Oc1ccc2C(=CC(=O)C(=O)c2c1)c1ccccc1
Show InChI InChI=1S/C26H20O5/c1-30-26(29)24(14-17-8-4-2-5-9-17)31-19-12-13-20-21(18-10-6-3-7-11-18)16-23(27)25(28)22(20)15-19/h2-13,15-16,24H,14H2,1H3
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n/an/a 2.54E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115741
PNG
(3-Pentyloxy-4-phenyl-[1,2]naphthoquinone | CHEMBL5...)
Show SMILES CCCCCOC1=C(c2ccccc2)c2ccccc2C(=O)C1=O
Show InChI InChI=1S/C21H20O3/c1-2-3-9-14-24-21-18(15-10-5-4-6-11-15)16-12-7-8-13-17(16)19(22)20(21)23/h4-8,10-13H,2-3,9,14H2,1H3
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n/an/a 2.69E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115734
PNG
(3-(3,4-Dioxo-3,4-dihydro-naphthalen-1-yl)-1H-indol...)
Show SMILES OC(=O)c1ccc2[nH]cc(C3=CC(=O)C(=O)c4ccccc34)c2c1
Show InChI InChI=1S/C19H11NO4/c21-17-8-13(11-3-1-2-4-12(11)18(17)22)15-9-20-16-6-5-10(19(23)24)7-14(15)16/h1-9,20H,(H,23,24)
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n/an/a 3.00E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Dual specificity phosphatase Cdc25B


(Homo sapiens (Human))
BDBM50115722
PNG
(4-Cyclohexyl-[1,2]naphthoquinone | CHEMBL58737)
Show SMILES O=C1C=C(C2CCCCC2)c2ccccc2C1=O
Show InChI InChI=1S/C16H16O2/c17-15-10-14(11-6-2-1-3-7-11)12-8-4-5-9-13(12)16(15)18/h4-5,8-11H,1-3,6-7H2
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n/an/a 3.00E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity of the compound against recombinant human Cdc25B using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Tyrosine-Protein Phosphatase (CD45)


(Homo sapiens (Human))
BDBM50115737
PNG
(4-(1H-Indol-3-yl)-[1,2]naphthoquinone | CHEMBL6070...)
Show SMILES O=C1C=C(c2c[nH]c3ccccc23)c2ccccc2C1=O
Show InChI InChI=1S/C18H11NO2/c20-17-9-14(11-5-1-2-7-13(11)18(17)21)15-10-19-16-8-4-3-6-12(15)16/h1-10,19H
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PubMed
n/an/a 3.07E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity of the compound against recombinant human CD45 using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Tyrosine-Protein Phosphatase (CD45)


(Homo sapiens (Human))
BDBM50115722
PNG
(4-Cyclohexyl-[1,2]naphthoquinone | CHEMBL58737)
Show SMILES O=C1C=C(C2CCCCC2)c2ccccc2C1=O
Show InChI InChI=1S/C16H16O2/c17-15-10-14(11-6-2-1-3-7-11)12-8-4-5-9-13(12)16(15)18/h4-5,8-11H,1-3,6-7H2
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n/an/a 3.27E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity of the compound against recombinant human CD45 using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115759
PNG
(4-Hexyl-[1,2]naphthoquinone | CHEMBL57920)
Show SMILES CCCCCCC1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C16H18O2/c1-2-3-4-5-8-12-11-15(17)16(18)14-10-7-6-9-13(12)14/h6-7,9-11H,2-5,8H2,1H3
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n/an/a 3.30E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115736
PNG
(4-Cyclopentyl-[1,2]naphthoquinone | CHEMBL58288)
Show SMILES O=C1C=C(C2CCCC2)c2ccccc2C1=O
Show InChI InChI=1S/C15H14O2/c16-14-9-13(10-5-1-2-6-10)11-7-3-4-8-12(11)15(14)17/h3-4,7-10H,1-2,5-6H2
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n/an/a 4.20E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115745
PNG
(3-(3,4-Dioxo-3,4-dihydro-naphthalen-1-yl)-1H-indol...)
Show SMILES OC(=O)c1ccc2c(c[nH]c2c1)C1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C19H11NO4/c21-17-8-14(11-3-1-2-4-13(11)18(17)22)15-9-20-16-7-10(19(23)24)5-6-12(15)16/h1-9,20H,(H,23,24)
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n/an/a 4.56E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115742
PNG
(4-(2,5-Dichloro-phenyl)-[1,2]naphthoquinone | CHEM...)
Show SMILES Clc1ccc(Cl)c(c1)C1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C16H8Cl2O2/c17-9-5-6-14(18)13(7-9)12-8-15(19)16(20)11-4-2-1-3-10(11)12/h1-8H
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n/an/a 5.05E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115726
PNG
(4-(4-Methoxy-phenyl)-[1,2]naphthoquinone | CHEMBL5...)
Show SMILES COc1ccc(cc1)C1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C17H12O3/c1-20-12-8-6-11(7-9-12)15-10-16(18)17(19)14-5-3-2-4-13(14)15/h2-10H,1H3
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n/an/a 5.24E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM36444
PNG
(CHEMBL61245 | CID1550768 | ZINC01669713, 8)
Show SMILES [O-]S(=O)(=O)C1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C10H6O5S/c11-8-5-9(16(13,14)15)6-3-1-2-4-7(6)10(8)12/h1-5H,(H,13,14,15)/p-1
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n/an/a 5.29E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115750
PNG
(4-Biphenyl-4-yl-[1,2]naphthoquinone | CHEMBL58287)
Show SMILES O=C1C=C(c2ccc(cc2)-c2ccccc2)c2ccccc2C1=O
Show InChI InChI=1S/C22H14O2/c23-21-14-20(18-8-4-5-9-19(18)22(21)24)17-12-10-16(11-13-17)15-6-2-1-3-7-15/h1-14H
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n/an/a 5.40E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115752
PNG
(4-(3,5-Di-tert-butyl-4-hydroxy-phenyl)-[1,2]naphth...)
Show SMILES CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C24H26O3/c1-23(2,3)18-11-14(12-19(22(18)27)24(4,5)6)17-13-20(25)21(26)16-10-8-7-9-15(16)17/h7-13,27H,1-6H3
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n/an/a 5.73E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein phosphatase F (LAR)


(Homo sapiens (Human))
BDBM50115731
PNG
(4-(3,4-Dioxo-3,4-dihydro-naphthalen-1-yl)-benzoic ...)
Show SMILES COC(=O)c1ccc(cc1)C1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C18H12O4/c1-22-18(21)12-8-6-11(7-9-12)15-10-16(19)17(20)14-5-3-2-4-13(14)15/h2-10H,1H3
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n/an/a 7.09E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity of the compound against recombinant human LAR using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115732
PNG
(CHEMBL294467 | Sodium vanadate)
Show SMILES [O-][V](=O)=O
Show InChI InChI=1S/3O.V/q;;-1;
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n/an/a 8.05E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein phosphatase F (LAR)


(Homo sapiens (Human))
BDBM50115722
PNG
(4-Cyclohexyl-[1,2]naphthoquinone | CHEMBL58737)
Show SMILES O=C1C=C(C2CCCCC2)c2ccccc2C1=O
Show InChI InChI=1S/C16H16O2/c17-15-10-14(11-6-2-1-3-7-11)12-8-4-5-9-13(12)16(15)18/h4-5,8-11H,1-3,6-7H2
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n/an/a 8.99E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity of the compound against recombinant human LAR using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Dual specificity phosphatase Cdc25B


(Homo sapiens (Human))
BDBM50099778
PNG
(4-Phenyl-[1,2]naphthoquinone | CHEMBL51447)
Show SMILES O=C1C=C(c2ccccc2)c2ccccc2C1=O
Show InChI InChI=1S/C16H10O2/c17-15-10-14(11-6-2-1-3-7-11)12-8-4-5-9-13(12)16(15)18/h1-10H
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n/an/a 9.52E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity of the compound against recombinant human Cdc25B using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115754
PNG
(4-Isopropyl-[1,2]naphthoquinone | CHEMBL58435)
Show SMILES CC(C)C1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C13H12O2/c1-8(2)11-7-12(14)13(15)10-6-4-3-5-9(10)11/h3-8H,1-2H3
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n/an/a 1.01E+4n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein phosphatase F (LAR)


(Homo sapiens (Human))
BDBM50115737
PNG
(4-(1H-Indol-3-yl)-[1,2]naphthoquinone | CHEMBL6070...)
Show SMILES O=C1C=C(c2c[nH]c3ccccc23)c2ccccc2C1=O
Show InChI InChI=1S/C18H11NO2/c20-17-9-14(11-5-1-2-7-13(11)18(17)21)15-10-19-16-8-4-3-6-12(15)16/h1-10,19H
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n/an/a 1.02E+4n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity of the compound against recombinant human LAR using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115723
PNG
(4-Amino-[1,2]naphthoquinone | CHEMBL60824 | cid_72...)
Show SMILES NC1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C10H7NO2/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5H,11H2
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n/an/a 2.46E+4n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115724
PNG
(4-Methoxy-[1,2]naphthoquinone | CHEMBL57796)
Show SMILES COC1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C11H8O3/c1-14-10-6-9(12)11(13)8-5-3-2-4-7(8)10/h2-6H,1H3
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n/an/a 2.91E+4n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115730
PNG
(4-(Methyl-phenyl-amino)-[1,2]naphthoquinone | CHEM...)
Show SMILES CN(C1=CC(=O)C(=O)c2ccccc12)c1ccccc1
Show InChI InChI=1S/C17H13NO2/c1-18(12-7-3-2-4-8-12)15-11-16(19)17(20)14-10-6-5-9-13(14)15/h2-11H,1H3
PDB
MMDB

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Article
PubMed
n/an/a 3.49E+4n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50115753
PNG
(4-(3-Hydroxy-propoxy)-[1,2]naphthoquinone | CHEMBL...)
Show SMILES OCCCOC1=CC(=O)C(=O)c2ccccc12
Show InChI InChI=1S/C13H12O4/c14-6-3-7-17-12-8-11(15)13(16)10-5-2-1-4-9(10)12/h1-2,4-5,8,14H,3,6-7H2
PDB
MMDB

NCI pathway
Reactome pathway
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UniChem

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Article
PubMed
n/an/a 3.65E+4n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against recombinant human protein-tyrosine phosphatase 1B (PTP1B) using fluoreacein diphosphate (FDP) as a substrate


Bioorg Med Chem Lett 12: 1941-6 (2002)


Article DOI: 10.1016/s0960-894x(02)00331-1
BindingDB Entry DOI: 10.7270/Q2QZ2999
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%