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PubMed code 14561096

Compile data set for download or QSAR
Found 16 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
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50409745
PNG
(CHEMBL145496)
Show SMILES Cc1ccc(cc1)-c1ccc(OCC(O)=O)c(c1)-c1ccccc1
Show InChI InChI=1S/C21H18O3/c1-15-7-9-16(10-8-15)18-11-12-20(24-14-21(22)23)19(13-18)17-5-3-2-4-6-17/h2-13H,14H2,1H3,(H,22,23)
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n/an/a 4.67E+7n/an/an/an/an/an/a



Leadscope, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity determined against Protein tyrosine phosphatase PTB1B


J Med Chem 46: 4770-5 (2003)


Article DOI: 10.1021/jm0302703
BindingDB Entry DOI: 10.7270/Q2HD7WV1
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50409755
PNG
(CHEMBL146011)
Show SMILES COc1ccc(cc1)-c1cc(ccc1OCC(O)=O)-c1ccc(C)cc1
Show InChI InChI=1S/C22H20O4/c1-15-3-5-16(6-4-15)18-9-12-21(26-14-22(23)24)20(13-18)17-7-10-19(25-2)11-8-17/h3-13H,14H2,1-2H3,(H,23,24)
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n/an/a 4.67E+7n/an/an/an/an/an/a



Leadscope, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity determined against Protein tyrosine phosphatase PTB1B


J Med Chem 46: 4770-5 (2003)


Article DOI: 10.1021/jm0302703
BindingDB Entry DOI: 10.7270/Q2HD7WV1
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50409752
PNG
(CHEMBL343636)
Show SMILES Cc1ccc(cc1)-c1ccc(O)c(C)c1
Show InChI InChI=1S/C14H14O/c1-10-3-5-12(6-4-10)13-7-8-14(15)11(2)9-13/h3-9,15H,1-2H3
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n/an/a 4.89E+7n/an/an/an/an/an/a



Leadscope, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity determined against Protein tyrosine phosphatase PTB1B


J Med Chem 46: 4770-5 (2003)


Article DOI: 10.1021/jm0302703
BindingDB Entry DOI: 10.7270/Q2HD7WV1
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50086897
PNG
(CHEMBL24213 | [4-(2-Benzyl-benzo[b]thiophen-3-yl)-...)
Show SMILES OC(=O)COc1ccc(cc1-c1ccccc1)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
Show InChI InChI=1S/C35H26O3S/c36-34(37)23-38-31-20-19-28(22-30(31)26-11-5-2-6-12-26)25-15-17-27(18-16-25)35-29-13-7-8-14-32(29)39-33(35)21-24-9-3-1-4-10-24/h1-20,22H,21,23H2,(H,36,37)
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n/an/a 4.89E+7n/an/an/an/an/an/a



Leadscope, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity determined against Protein tyrosine phosphatase PTB1B


J Med Chem 46: 4770-5 (2003)


Article DOI: 10.1021/jm0302703
BindingDB Entry DOI: 10.7270/Q2HD7WV1
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50409753
PNG
(CHEMBL342960)
Show SMILES O=S(=O)(Oc1ccc(cc1)-c1ccccc1)c1ccccc1
Show InChI InChI=1S/C18H14O3S/c19-22(20,18-9-5-2-6-10-18)21-17-13-11-16(12-14-17)15-7-3-1-4-8-15/h1-14H
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n/an/a 6.02E+7n/an/an/an/an/an/a



Leadscope, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity determined against Protein tyrosine phosphatase PTB1B


J Med Chem 46: 4770-5 (2003)


Article DOI: 10.1021/jm0302703
BindingDB Entry DOI: 10.7270/Q2HD7WV1
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50409747
PNG
(CHEMBL145657)
Show SMILES CCOc1ccccc1C
Show InChI InChI=1S/C9H12O/c1-3-10-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3
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n/an/a 6.16E+7n/an/an/an/an/an/a



Leadscope, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity determined against Protein tyrosine phosphatase PTB1B


J Med Chem 46: 4770-5 (2003)


Article DOI: 10.1021/jm0302703
BindingDB Entry DOI: 10.7270/Q2HD7WV1
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50409751
PNG
(CHEMBL144243)
Show SMILES OC(=O)COc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
Show InChI InChI=1S/C29H22O3S/c30-28(31)19-32-24-16-14-22(15-17-24)21-10-12-23(13-11-21)29-25-8-4-5-9-26(25)33-27(29)18-20-6-2-1-3-7-20/h1-17H,18-19H2,(H,30,31)
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n/an/a 7.07E+7n/an/an/an/an/an/a



Leadscope, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity determined against Protein tyrosine phosphatase PTB1B


J Med Chem 46: 4770-5 (2003)


Article DOI: 10.1021/jm0302703
BindingDB Entry DOI: 10.7270/Q2HD7WV1
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50409749
PNG
(CHEMBL145393)
Show SMILES OC(=O)COc1ccc(cc1Br)-c1ccccc1
Show InChI InChI=1S/C14H11BrO3/c15-12-8-11(10-4-2-1-3-5-10)6-7-13(12)18-9-14(16)17/h1-8H,9H2,(H,16,17)
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n/an/a 7.24E+7n/an/an/an/an/an/a



Leadscope, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity determined against Protein tyrosine phosphatase PTB1B


J Med Chem 46: 4770-5 (2003)


Article DOI: 10.1021/jm0302703
BindingDB Entry DOI: 10.7270/Q2HD7WV1
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50409754
PNG
(CHEMBL146008)
Show SMILES OC(=O)COc1ccc(cc1)-c1ccc(cc1)-c1ccsc1Cc1ccccc1
Show InChI InChI=1S/C25H20O3S/c26-25(27)17-28-22-12-10-20(11-13-22)19-6-8-21(9-7-19)23-14-15-29-24(23)16-18-4-2-1-3-5-18/h1-15H,16-17H2,(H,26,27)
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n/an/a 8.31E+7n/an/an/an/an/an/a



Leadscope, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity determined against Protein tyrosine phosphatase PTB1B


J Med Chem 46: 4770-5 (2003)


Article DOI: 10.1021/jm0302703
BindingDB Entry DOI: 10.7270/Q2HD7WV1
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50409750
PNG
(CHEMBL434128)
Show SMILES CCc1sc2ccccc2c1-c1ccc(cc1)-c1ccc(OCC(O)=O)cc1
Show InChI InChI=1S/C24H20O3S/c1-2-21-24(20-5-3-4-6-22(20)28-21)18-9-7-16(8-10-18)17-11-13-19(14-12-17)27-15-23(25)26/h3-14H,2,15H2,1H3,(H,25,26)
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n/an/a 8.91E+7n/an/an/an/an/an/a



Leadscope, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity determined against Protein tyrosine phosphatase PTB1B


J Med Chem 46: 4770-5 (2003)


Article DOI: 10.1021/jm0302703
BindingDB Entry DOI: 10.7270/Q2HD7WV1
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50409748
PNG
(CHEMBL24095)
Show SMILES Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
Show InChI InChI=1S/C27H20OS/c28-23-16-14-21(15-17-23)20-10-12-22(13-11-20)27-24-8-4-5-9-25(24)29-26(27)18-19-6-2-1-3-7-19/h1-17,28H,18H2
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n/an/a 9.33E+7n/an/an/an/an/an/a



Leadscope, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity determined against Protein tyrosine phosphatase PTB1B


J Med Chem 46: 4770-5 (2003)


Article DOI: 10.1021/jm0302703
BindingDB Entry DOI: 10.7270/Q2HD7WV1
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50149238
PNG
(4-Hydroxybiphenyl | 4-Phenylphenol | 4-biphenylol ...)
Show SMILES Oc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C12H10O/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9,13H
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n/an/a 1.62E+8n/an/an/an/an/an/a



Leadscope, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity determined against Protein tyrosine phosphatase PTB1B


J Med Chem 46: 4770-5 (2003)


Article DOI: 10.1021/jm0302703
BindingDB Entry DOI: 10.7270/Q2HD7WV1
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50086890
PNG
(6-(2-Butyl-benzofuran-3-ylmethyl)-naphthalen-2-ol ...)
Show SMILES CCCCc1oc2ccccc2c1Cc1ccc2cc(O)ccc2c1
Show InChI InChI=1S/C23H22O2/c1-2-3-7-23-21(20-6-4-5-8-22(20)25-23)14-16-9-10-18-15-19(24)12-11-17(18)13-16/h4-6,8-13,15,24H,2-3,7,14H2,1H3
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n/an/a 6.76E+8n/an/an/an/an/an/a



Leadscope, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity determined against Protein tyrosine phosphatase PTB1B


J Med Chem 46: 4770-5 (2003)


Article DOI: 10.1021/jm0302703
BindingDB Entry DOI: 10.7270/Q2HD7WV1
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50409746
PNG
(CHEMBL344564)
Show SMILES CCCCc1oc2ccccc2c1Cc1ccccc1
Show InChI InChI=1S/C19H20O/c1-2-3-12-19-17(14-15-9-5-4-6-10-15)16-11-7-8-13-18(16)20-19/h4-11,13H,2-3,12,14H2,1H3
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n/an/a 6.91E+8n/an/an/an/an/an/a



Leadscope, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity determined against Protein tyrosine phosphatase PTB1B


J Med Chem 46: 4770-5 (2003)


Article DOI: 10.1021/jm0302703
BindingDB Entry DOI: 10.7270/Q2HD7WV1
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50409743
PNG
(CHEMBL341624)
Show SMILES CCCCc1oc2ccccc2c1C
Show InChI InChI=1S/C13H16O/c1-3-4-8-12-10(2)11-7-5-6-9-13(11)14-12/h5-7,9H,3-4,8H2,1-2H3
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n/an/a 7.07E+8n/an/an/an/an/an/a



Leadscope, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity determined against Protein tyrosine phosphatase PTB1B


J Med Chem 46: 4770-5 (2003)


Article DOI: 10.1021/jm0302703
BindingDB Entry DOI: 10.7270/Q2HD7WV1
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50409744
PNG
(CHEMBL344565)
Show SMILES Cc1ccc2cc(O)ccc2c1
Show InChI InChI=1S/C11H10O/c1-8-2-3-10-7-11(12)5-4-9(10)6-8/h2-7,12H,1H3
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n/an/a 7.07E+8n/an/an/an/an/an/a



Leadscope, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity determined against Protein tyrosine phosphatase PTB1B


J Med Chem 46: 4770-5 (2003)


Article DOI: 10.1021/jm0302703
BindingDB Entry DOI: 10.7270/Q2HD7WV1
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%