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PubMed code 18436346

Compile data set for download or QSAR
Found 28 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))
BDBM50266158
PNG
(CHEMBL510225 | Dimethyl-[2-(4-naphtho[1,2-d]oxazol...)
Show SMILES CN(C)CCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C21H20N2O2/c1-23(2)13-14-24-17-10-7-16(8-11-17)21-22-20-18-6-4-3-5-15(18)9-12-19(20)25-21/h3-12H,13-14H2,1-2H3
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PubMed
2.51E+4n/an/an/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266161
PNG
(2-[4-(2-Piperidine-1-yl-ethoxy)-phenyl]-naphtho[1,...)
Show SMILES C(CN1CCCCC1)Oc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C24H24N2O2/c1-4-14-26(15-5-1)16-17-27-20-11-8-19(9-12-20)24-25-23-21-7-3-2-6-18(21)10-13-22(23)28-24/h2-3,6-13H,1,4-5,14-17H2
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PubMed
2.71E+4n/an/an/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity in presence of Triton X-100


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266161
PNG
(2-[4-(2-Piperidine-1-yl-ethoxy)-phenyl]-naphtho[1,...)
Show SMILES C(CN1CCCCC1)Oc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C24H24N2O2/c1-4-14-26(15-5-1)16-17-27-20-11-8-19(9-12-20)24-25-23-21-7-3-2-6-18(21)10-13-22(23)28-24/h2-3,6-13H,1,4-5,14-17H2
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PubMed
2.75E+4n/an/an/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266158
PNG
(CHEMBL510225 | Dimethyl-[2-(4-naphtho[1,2-d]oxazol...)
Show SMILES CN(C)CCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C21H20N2O2/c1-23(2)13-14-24-17-10-7-16(8-11-17)21-22-20-18-6-4-3-5-15(18)9-12-19(20)25-21/h3-12H,13-14H2,1-2H3
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PubMed
2.87E+4n/an/an/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity in presence of Triton X-100


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266231
PNG
(CHEMBL510460 | Dimethyl-[3-(4-naphtho[1,2-d]oxazol...)
Show SMILES CN(C)CCCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C22H22N2O2/c1-24(2)14-5-15-25-18-11-8-17(9-12-18)22-23-21-19-7-4-3-6-16(19)10-13-20(21)26-22/h3-4,6-13H,5,14-15H2,1-2H3
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PubMed
3.41E+4n/an/an/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266160
PNG
(2-[4-(2-Pyrrolidin-1-yl-ethoxy)-phenyl]-naphtho[1,...)
Show SMILES C(CN1CCCC1)Oc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C23H22N2O2/c1-2-6-20-17(5-1)9-12-21-22(20)24-23(27-21)18-7-10-19(11-8-18)26-16-15-25-13-3-4-14-25/h1-2,5-12H,3-4,13-16H2
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PubMed
3.42E+4n/an/an/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266159
PNG
(CHEMBL506882 | Diethyl-[2-(4-naphtho[1,2-d]oxazol-...)
Show SMILES CCN(CC)CCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C23H24N2O2/c1-3-25(4-2)15-16-26-19-12-9-18(10-13-19)23-24-22-20-8-6-5-7-17(20)11-14-21(22)27-23/h5-14H,3-4,15-16H2,1-2H3
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PubMed
3.50E+4n/an/an/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266231
PNG
(CHEMBL510460 | Dimethyl-[3-(4-naphtho[1,2-d]oxazol...)
Show SMILES CN(C)CCCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C22H22N2O2/c1-24(2)14-5-15-25-18-11-8-17(9-12-18)22-23-21-19-7-4-3-6-16(19)10-13-20(21)26-22/h3-4,6-13H,5,14-15H2,1-2H3
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PubMed
3.63E+4n/an/an/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity in presence of Triton X-100


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266160
PNG
(2-[4-(2-Pyrrolidin-1-yl-ethoxy)-phenyl]-naphtho[1,...)
Show SMILES C(CN1CCCC1)Oc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C23H22N2O2/c1-2-6-20-17(5-1)9-12-21-22(20)24-23(27-21)18-7-10-19(11-8-18)26-16-15-25-13-3-4-14-25/h1-2,5-12H,3-4,13-16H2
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PubMed
3.70E+4n/an/an/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity in presence of Triton X-100


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266232
PNG
(CHEMBL458009 | Diethyl-[3-(4-naphtho[1,2-d]oxazol-...)
Show SMILES CCN(CC)CCCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C24H26N2O2/c1-3-26(4-2)16-7-17-27-20-13-10-19(11-14-20)24-25-23-21-9-6-5-8-18(21)12-15-22(23)28-24/h5-6,8-15H,3-4,7,16-17H2,1-2H3
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PubMed
4.05E+4n/an/an/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266162
PNG
(Butyl-methyl-[2-(4-naphtho[1,2-d]oxazol-2-yl-pheno...)
Show SMILES CCCCN(C)CCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C24H26N2O2/c1-3-4-15-26(2)16-17-27-20-12-9-19(10-13-20)24-25-23-21-8-6-5-7-18(21)11-14-22(23)28-24/h5-14H,3-4,15-17H2,1-2H3
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4.10E+4n/an/an/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity in presence of Triton X-100


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266232
PNG
(CHEMBL458009 | Diethyl-[3-(4-naphtho[1,2-d]oxazol-...)
Show SMILES CCN(CC)CCCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C24H26N2O2/c1-3-26(4-2)16-7-17-27-20-13-10-19(11-14-20)24-25-23-21-9-6-5-8-18(21)12-15-22(23)28-24/h5-6,8-15H,3-4,7,16-17H2,1-2H3
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PubMed
4.10E+4n/an/an/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity in presence of Triton X-100


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266162
PNG
(Butyl-methyl-[2-(4-naphtho[1,2-d]oxazol-2-yl-pheno...)
Show SMILES CCCCN(C)CCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C24H26N2O2/c1-3-4-15-26(2)16-17-27-20-12-9-19(10-13-20)24-25-23-21-8-6-5-7-18(21)11-14-22(23)28-24/h5-14H,3-4,15-17H2,1-2H3
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PubMed
4.44E+4n/an/an/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266159
PNG
(CHEMBL506882 | Diethyl-[2-(4-naphtho[1,2-d]oxazol-...)
Show SMILES CCN(CC)CCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C23H24N2O2/c1-3-25(4-2)15-16-26-19-12-9-18(10-13-19)23-24-22-20-8-6-5-7-17(20)11-14-21(22)27-23/h5-14H,3-4,15-16H2,1-2H3
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PubMed
3.55E+5n/an/an/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity in presence of Triton X-100


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266161
PNG
(2-[4-(2-Piperidine-1-yl-ethoxy)-phenyl]-naphtho[1,...)
Show SMILES C(CN1CCCCC1)Oc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C24H24N2O2/c1-4-14-26(15-5-1)16-17-27-20-11-8-19(9-12-20)24-25-23-21-7-3-2-6-18(21)10-13-22(23)28-24/h2-3,6-13H,1,4-5,14-17H2
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n/an/a 1.86E+3n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity in presence of Triton X-100


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266161
PNG
(2-[4-(2-Piperidine-1-yl-ethoxy)-phenyl]-naphtho[1,...)
Show SMILES C(CN1CCCCC1)Oc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C24H24N2O2/c1-4-14-26(15-5-1)16-17-27-20-11-8-19(9-12-20)24-25-23-21-7-3-2-6-18(21)10-13-22(23)28-24/h2-3,6-13H,1,4-5,14-17H2
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n/an/a 1.90E+3n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266162
PNG
(Butyl-methyl-[2-(4-naphtho[1,2-d]oxazol-2-yl-pheno...)
Show SMILES CCCCN(C)CCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C24H26N2O2/c1-3-4-15-26(2)16-17-27-20-12-9-19(10-13-20)24-25-23-21-8-6-5-7-18(21)11-14-22(23)28-24/h5-14H,3-4,15-17H2,1-2H3
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n/an/a 2.50E+3n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266162
PNG
(Butyl-methyl-[2-(4-naphtho[1,2-d]oxazol-2-yl-pheno...)
Show SMILES CCCCN(C)CCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C24H26N2O2/c1-3-4-15-26(2)16-17-27-20-12-9-19(10-13-20)24-25-23-21-8-6-5-7-18(21)11-14-22(23)28-24/h5-14H,3-4,15-17H2,1-2H3
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n/an/a 2.52E+3n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity in presence of Triton X-100


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266232
PNG
(CHEMBL458009 | Diethyl-[3-(4-naphtho[1,2-d]oxazol-...)
Show SMILES CCN(CC)CCCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C24H26N2O2/c1-3-26(4-2)16-7-17-27-20-13-10-19(11-14-20)24-25-23-21-9-6-5-8-18(21)12-15-22(23)28-24/h5-6,8-15H,3-4,7,16-17H2,1-2H3
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n/an/a 3.36E+3n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity in presence of Triton X-100


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266232
PNG
(CHEMBL458009 | Diethyl-[3-(4-naphtho[1,2-d]oxazol-...)
Show SMILES CCN(CC)CCCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C24H26N2O2/c1-3-26(4-2)16-7-17-27-20-13-10-19(11-14-20)24-25-23-21-9-6-5-8-18(21)12-15-22(23)28-24/h5-6,8-15H,3-4,7,16-17H2,1-2H3
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n/an/a 3.40E+3n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266231
PNG
(CHEMBL510460 | Dimethyl-[3-(4-naphtho[1,2-d]oxazol...)
Show SMILES CN(C)CCCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C22H22N2O2/c1-24(2)14-5-15-25-18-11-8-17(9-12-18)22-23-21-19-7-4-3-6-16(19)10-13-20(21)26-22/h3-4,6-13H,5,14-15H2,1-2H3
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n/an/a 3.50E+3n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266158
PNG
(CHEMBL510225 | Dimethyl-[2-(4-naphtho[1,2-d]oxazol...)
Show SMILES CN(C)CCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C21H20N2O2/c1-23(2)13-14-24-17-10-7-16(8-11-17)21-22-20-18-6-4-3-5-15(18)9-12-19(20)25-21/h3-12H,13-14H2,1-2H3
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n/an/a 3.51E+3n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266231
PNG
(CHEMBL510460 | Dimethyl-[3-(4-naphtho[1,2-d]oxazol...)
Show SMILES CN(C)CCCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C22H22N2O2/c1-24(2)14-5-15-25-18-11-8-17(9-12-18)22-23-21-19-7-4-3-6-16(19)10-13-20(21)26-22/h3-4,6-13H,5,14-15H2,1-2H3
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n/an/a 3.52E+3n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity in presence of Triton X-100


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266158
PNG
(CHEMBL510225 | Dimethyl-[2-(4-naphtho[1,2-d]oxazol...)
Show SMILES CN(C)CCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C21H20N2O2/c1-23(2)13-14-24-17-10-7-16(8-11-17)21-22-20-18-6-4-3-5-15(18)9-12-19(20)25-21/h3-12H,13-14H2,1-2H3
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n/an/a 3.56E+3n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity in presence of Triton X-100


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266159
PNG
(CHEMBL506882 | Diethyl-[2-(4-naphtho[1,2-d]oxazol-...)
Show SMILES CCN(CC)CCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C23H24N2O2/c1-3-25(4-2)15-16-26-19-12-9-18(10-13-19)23-24-22-20-8-6-5-7-17(20)11-14-21(22)27-23/h5-14H,3-4,15-16H2,1-2H3
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n/an/a 4.55E+3n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity in presence of Triton X-100


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266159
PNG
(CHEMBL506882 | Diethyl-[2-(4-naphtho[1,2-d]oxazol-...)
Show SMILES CCN(CC)CCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C23H24N2O2/c1-3-25(4-2)15-16-26-19-12-9-18(10-13-19)23-24-22-20-8-6-5-7-17(20)11-14-21(22)27-23/h5-14H,3-4,15-16H2,1-2H3
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n/an/a 4.60E+3n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266160
PNG
(2-[4-(2-Pyrrolidin-1-yl-ethoxy)-phenyl]-naphtho[1,...)
Show SMILES C(CN1CCCC1)Oc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C23H22N2O2/c1-2-6-20-17(5-1)9-12-21-22(20)24-23(27-21)18-7-10-19(11-8-18)26-16-15-25-13-3-4-14-25/h1-2,5-12H,3-4,13-16H2
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n/an/a 5.70E+3n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity in presence of Triton X-100


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50266160
PNG
(2-[4-(2-Pyrrolidin-1-yl-ethoxy)-phenyl]-naphtho[1,...)
Show SMILES C(CN1CCCC1)Oc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
Show InChI InChI=1S/C23H22N2O2/c1-2-6-20-17(5-1)9-12-21-22(20)24-23(27-21)18-7-10-19(11-8-18)26-16-15-25-13-3-4-14-25/h1-2,5-12H,3-4,13-16H2
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n/an/a 5.71E+3n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of of PTP1B (unknown origin) assessed as residual enzyme activity


Eur J Med Chem 44: 109-16 (2008)


Article DOI: 10.1016/j.ejmech.2008.03.009
BindingDB Entry DOI: 10.7270/Q2FN1602
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%