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20 similar compounds to monomer 50118792

Compile data set for download or QSAR
Wt: 358.4
BDBM75215
Wt: 386.5
BDBM75221
Purchase
Wt: 372.4
BDBM75223
Wt: 360.3
BDBM50118774
Wt: 480.5
BDBM50118784
Wt: 390.4
BDBM50118786
Wt: 388.4
BDBM50118790
Wt: 375.3
BDBM50118791
Wt: 284.2
BDBM50118793
Wt: 361.3
BDBM50118794
Wt: 410.4
BDBM50118773
Wt: 375.3
BDBM50118748
Wt: 374.4
BDBM50118750
Wt: 361.3
BDBM50118742
Wt: 464.5
BDBM50118752
Displayed 1 to 15 (of 20 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 37 hits for monomerid = 75215,75221,75223,50118774,50118784,50118786,50118790,50118791,50118793,50118794,50118773,50118748,50118750,50118742,50118752   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118750
PNG
(2-(Oxalyl-amino)-6-phenethyl-4,5,6,7-tetrahydro-th...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCc3ccccc3)CCc2c1C(O)=O
Show InChI InChI=1S/C18H18N2O5S/c21-15(18(24)25)19-16-14(17(22)23)12-7-9-20(10-13(12)26-16)8-6-11-4-2-1-3-5-11/h1-5H,6-10H2,(H,19,21)(H,22,23)(H,24,25)
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270n/an/an/an/an/an/a5.5n/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PTP1B (1 to 321 residues) catalytic domain expressed in Escherichia coli BL21 (DE3) cells using p-nitrophenyl phospha...


Bioorg Med Chem 24: 3343-52 (2016)


Article DOI: 10.1016/j.bmc.2016.06.035
BindingDB Entry DOI: 10.7270/Q20Z756P
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118750
PNG
(2-(Oxalyl-amino)-6-phenethyl-4,5,6,7-tetrahydro-th...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCc3ccccc3)CCc2c1C(O)=O
Show InChI InChI=1S/C18H18N2O5S/c21-15(18(24)25)19-16-14(17(22)23)12-7-9-20(10-13(12)26-16)8-6-11-4-2-1-3-5-11/h1-5H,6-10H2,(H,19,21)(H,22,23)(H,24,25)
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270n/an/an/an/an/an/a5.5n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibitory effect against recombinant human protein-tyrosine phosphatase 1B (PTP1B), using p-nitrophenyl phosphate substrate at pH 5.5.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118786
PNG
(6-(3-Methoxy-benzyl)-2-(oxalyl-amino)-4,5,6,7-tetr...)
Show SMILES COc1cccc(CN2CCc3c(C2)sc(NC(=O)C(O)=O)c3C(O)=O)c1
Show InChI InChI=1S/C18H18N2O6S/c1-26-11-4-2-3-10(7-11)8-20-6-5-12-13(9-20)27-16(14(12)17(22)23)19-15(21)18(24)25/h2-4,7H,5-6,8-9H2,1H3,(H,19,21)(H,22,23)(H,24,25)
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700n/an/an/an/an/an/a5.5n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibitory effect against recombinant human protein-tyrosine phosphatase 1B (PTP1B), using p-nitrophenyl phosphate substrate at pH 5.5.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118794
PNG
(2-(Oxalyl-amino)-6-pyridin-3-ylmethyl-4,5,6,7-tetr...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(Cc3cccnc3)CCc2c1C(O)=O
Show InChI InChI=1S/C16H15N3O5S/c20-13(16(23)24)18-14-12(15(21)22)10-3-5-19(8-11(10)25-14)7-9-2-1-4-17-6-9/h1-2,4,6H,3,5,7-8H2,(H,18,20)(H,21,22)(H,23,24)
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900n/an/an/an/an/an/a5.5n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibitory effect against recombinant human protein-tyrosine phosphatase 1B (PTP1B), using p-nitrophenyl phosphate substrate at pH 5.5.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118774
PNG
(6-Benzyl-2-(oxalyl-amino)-4,5,6,7-tetrahydro-thien...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(Cc3ccccc3)CCc2c1C(O)=O
Show InChI InChI=1S/C17H16N2O5S/c20-14(17(23)24)18-15-13(16(21)22)11-6-7-19(9-12(11)25-15)8-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,18,20)(H,21,22)(H,23,24)
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1.00E+3n/an/an/an/an/an/a5.5n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibitory effect against recombinant human protein-tyrosine phosphatase 1B (PTP1B), using p-nitrophenyl phosphate substrate at pH 5.5.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118793
PNG
(6-Methyl-2-(oxalyl-amino)-4,5,6,7-tetrahydro-thien...)
Show SMILES CN1CCc2c(C1)sc(NC(=O)C(O)=O)c2C(O)=O
Show InChI InChI=1S/C11H12N2O5S/c1-13-3-2-5-6(4-13)19-9(7(5)10(15)16)12-8(14)11(17)18/h2-4H2,1H3,(H,12,14)(H,15,16)(H,17,18)
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1.00E+3n/an/an/an/an/an/a5.5n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibitory effect against recombinant human protein-tyrosine phosphatase 1B (PTP1B), using p-nitrophenyl phosphate substrate at pH 5.5.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118742
PNG
(2-(Oxalyl-amino)-6-pyridin-2-ylmethyl-4,5,6,7-tetr...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(Cc3ccccn3)CCc2c1C(O)=O
Show InChI InChI=1S/C16H15N3O5S/c20-13(16(23)24)18-14-12(15(21)22)10-4-6-19(8-11(10)25-14)7-9-3-1-2-5-17-9/h1-3,5H,4,6-8H2,(H,18,20)(H,21,22)(H,23,24)
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1.00E+3n/an/an/an/an/an/a5.5n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibitory effect against recombinant human protein-tyrosine phosphatase 1B (PTP1B), using p-nitrophenyl phosphate substrate at pH 5.5.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118750
PNG
(2-(Oxalyl-amino)-6-phenethyl-4,5,6,7-tetrahydro-th...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCc3ccccc3)CCc2c1C(O)=O
Show InChI InChI=1S/C18H18N2O5S/c21-15(18(24)25)19-16-14(17(22)23)12-7-9-20(10-13(12)26-16)8-6-11-4-2-1-3-5-11/h1-5H,6-10H2,(H,19,21)(H,22,23)(H,24,25)
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3.20E+3n/an/an/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Protein-tyrosine phosphatase 1B.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase alpha


(Homo sapiens (Human))
BDBM50118752
PNG
(6-(3,3-Diphenyl-propyl)-2-(oxalyl-amino)-4,5,6,7-t...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCC(c3ccccc3)c3ccccc3)CCc2c1C(O)=O
Show InChI InChI=1S/C25H24N2O5S/c28-22(25(31)32)26-23-21(24(29)30)19-12-14-27(15-20(19)33-23)13-11-18(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,18H,11-15H2,(H,26,28)(H,29,30)(H,31,32)
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5.80E+3n/an/an/an/an/an/a7.0n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibitory effect against T cell protein tyrosine phosphatase (TC-PTP) using p-nitrophenyl phosphate as substrate at pH 7.0


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118752
PNG
(6-(3,3-Diphenyl-propyl)-2-(oxalyl-amino)-4,5,6,7-t...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCC(c3ccccc3)c3ccccc3)CCc2c1C(O)=O
Show InChI InChI=1S/C25H24N2O5S/c28-22(25(31)32)26-23-21(24(29)30)19-12-14-27(15-20(19)33-23)13-11-18(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,18H,11-15H2,(H,26,28)(H,29,30)(H,31,32)
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5.90E+3n/an/an/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Protein-tyrosine phosphatase 1B.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118750
PNG
(2-(Oxalyl-amino)-6-phenethyl-4,5,6,7-tetrahydro-th...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCc3ccccc3)CCc2c1C(O)=O
Show InChI InChI=1S/C18H18N2O5S/c21-15(18(24)25)19-16-14(17(22)23)12-7-9-20(10-13(12)26-16)8-6-11-4-2-1-3-5-11/h1-5H,6-10H2,(H,19,21)(H,22,23)(H,24,25)
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7.20E+3n/an/an/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Protein-tyrosine phosphatase 1B.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 2


(Homo sapiens (Human))
BDBM50118750
PNG
(2-(Oxalyl-amino)-6-phenethyl-4,5,6,7-tetrahydro-th...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCc3ccccc3)CCc2c1C(O)=O
Show InChI InChI=1S/C18H18N2O5S/c21-15(18(24)25)19-16-14(17(22)23)12-7-9-20(10-13(12)26-16)8-6-11-4-2-1-3-5-11/h1-5H,6-10H2,(H,19,21)(H,22,23)(H,24,25)
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7.20E+3n/an/an/an/an/an/a7.0n/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of recombinant TCPTP (unknown origin) at pH 7


Bioorg Med Chem 24: 3343-52 (2016)


Article DOI: 10.1016/j.bmc.2016.06.035
BindingDB Entry DOI: 10.7270/Q20Z756P
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118790
PNG
(2-(Oxalyl-amino)-6-(3-phenyl-propyl)-4,5,6,7-tetra...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCCc3ccccc3)CCc2c1C(O)=O
Show InChI InChI=1S/C19H20N2O5S/c22-16(19(25)26)20-17-15(18(23)24)13-8-10-21(11-14(13)27-17)9-4-7-12-5-2-1-3-6-12/h1-3,5-6H,4,7-11H2,(H,20,22)(H,23,24)(H,25,26)
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7.30E+3n/an/an/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Protein-tyrosine phosphatase 1B.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118786
PNG
(6-(3-Methoxy-benzyl)-2-(oxalyl-amino)-4,5,6,7-tetr...)
Show SMILES COc1cccc(CN2CCc3c(C2)sc(NC(=O)C(O)=O)c3C(O)=O)c1
Show InChI InChI=1S/C18H18N2O6S/c1-26-11-4-2-3-10(7-11)8-20-6-5-12-13(9-20)27-16(14(12)17(22)23)19-15(21)18(24)25/h2-4,7H,5-6,8-9H2,1H3,(H,19,21)(H,22,23)(H,24,25)
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8.30E+3n/an/an/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Protein-tyrosine phosphatase 1B.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118748
PNG
(2-(Oxalyl-amino)-6-(2-pyridin-4-yl-ethyl)-4,5,6,7-...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCc3ccncc3)CCc2c1C(O)=O
Show InChI InChI=1S/C17H17N3O5S/c21-14(17(24)25)19-15-13(16(22)23)11-4-8-20(9-12(11)26-15)7-3-10-1-5-18-6-2-10/h1-2,5-6H,3-4,7-9H2,(H,19,21)(H,22,23)(H,24,25)
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8.70E+3n/an/an/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Protein-tyrosine phosphatase 1B.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 2


(Homo sapiens (Human))
BDBM50118784
PNG
(6-[2-(4-Benzyloxy-phenyl)-ethyl]-2-(oxalyl-amino)-...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCc3ccc(OCc4ccccc4)cc3)CCc2c1C(O)=O
Show InChI InChI=1S/C25H24N2O6S/c28-22(25(31)32)26-23-21(24(29)30)19-11-13-27(14-20(19)34-23)12-10-16-6-8-18(9-7-16)33-15-17-4-2-1-3-5-17/h1-9H,10-15H2,(H,26,28)(H,29,30)(H,31,32)
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1.00E+4n/an/an/an/an/an/a7.0n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of T cell protein tyrosine phosphatase (TC-PTP) at pH 7.0


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118793
PNG
(6-Methyl-2-(oxalyl-amino)-4,5,6,7-tetrahydro-thien...)
Show SMILES CN1CCc2c(C1)sc(NC(=O)C(O)=O)c2C(O)=O
Show InChI InChI=1S/C11H12N2O5S/c1-13-3-2-5-6(4-13)19-9(7(5)10(15)16)12-8(14)11(17)18/h2-4H2,1H3,(H,12,14)(H,15,16)(H,17,18)
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1.10E+4n/an/an/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Protein-tyrosine phosphatase 1B.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118794
PNG
(2-(Oxalyl-amino)-6-pyridin-3-ylmethyl-4,5,6,7-tetr...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(Cc3cccnc3)CCc2c1C(O)=O
Show InChI InChI=1S/C16H15N3O5S/c20-13(16(23)24)18-14-12(15(21)22)10-3-5-19(8-11(10)25-14)7-9-2-1-4-17-6-9/h1-2,4,6H,3,5,7-8H2,(H,18,20)(H,21,22)(H,23,24)
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1.20E+4n/an/an/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Protein-tyrosine phosphatase 1B.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 2


(Homo sapiens (Human))
BDBM50118790
PNG
(2-(Oxalyl-amino)-6-(3-phenyl-propyl)-4,5,6,7-tetra...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCCc3ccccc3)CCc2c1C(O)=O
Show InChI InChI=1S/C19H20N2O5S/c22-16(19(25)26)20-17-15(18(23)24)13-8-10-21(11-14(13)27-17)9-4-7-12-5-2-1-3-6-12/h1-3,5-6H,4,7-11H2,(H,20,22)(H,23,24)(H,25,26)
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1.20E+4n/an/an/an/an/an/a7.0n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of T cell protein tyrosine phosphatase (TC-PTP) at pH 7.0


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118791
PNG
(2-(Oxalyl-amino)-6-(2-pyridin-2-yl-ethyl)-4,5,6,7-...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCc3ccccn3)CCc2c1C(O)=O
Show InChI InChI=1S/C17H17N3O5S/c21-14(17(24)25)19-15-13(16(22)23)11-5-8-20(9-12(11)26-15)7-4-10-3-1-2-6-18-10/h1-3,6H,4-5,7-9H2,(H,19,21)(H,22,23)(H,24,25)
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1.20E+4n/an/an/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Protein-tyrosine phosphatase 1B.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 2


(Homo sapiens (Human))
BDBM50118748
PNG
(2-(Oxalyl-amino)-6-(2-pyridin-4-yl-ethyl)-4,5,6,7-...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCc3ccncc3)CCc2c1C(O)=O
Show InChI InChI=1S/C17H17N3O5S/c21-14(17(24)25)19-15-13(16(22)23)11-4-8-20(9-12(11)26-15)7-3-10-1-5-18-6-2-10/h1-2,5-6H,3-4,7-9H2,(H,19,21)(H,22,23)(H,24,25)
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1.30E+4n/an/an/an/an/an/a7.0n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of T cell protein tyrosine phosphatase (TC-PTP) at pH 7.0


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118774
PNG
(6-Benzyl-2-(oxalyl-amino)-4,5,6,7-tetrahydro-thien...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(Cc3ccccc3)CCc2c1C(O)=O
Show InChI InChI=1S/C17H16N2O5S/c20-14(17(23)24)18-15-13(16(21)22)11-6-7-19(9-12(11)25-15)8-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,18,20)(H,21,22)(H,23,24)
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1.40E+4n/an/an/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Protein-tyrosine phosphatase 1B.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118784
PNG
(6-[2-(4-Benzyloxy-phenyl)-ethyl]-2-(oxalyl-amino)-...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCc3ccc(OCc4ccccc4)cc3)CCc2c1C(O)=O
Show InChI InChI=1S/C25H24N2O6S/c28-22(25(31)32)26-23-21(24(29)30)19-11-13-27(14-20(19)34-23)12-10-16-6-8-18(9-7-16)33-15-17-4-2-1-3-5-17/h1-9H,10-15H2,(H,26,28)(H,29,30)(H,31,32)
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1.50E+4n/an/an/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Protein-tyrosine phosphatase 1B.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 2


(Homo sapiens (Human))
BDBM50118791
PNG
(2-(Oxalyl-amino)-6-(2-pyridin-2-yl-ethyl)-4,5,6,7-...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCc3ccccn3)CCc2c1C(O)=O
Show InChI InChI=1S/C17H17N3O5S/c21-14(17(24)25)19-15-13(16(22)23)11-5-8-20(9-12(11)26-15)7-4-10-3-1-2-6-18-10/h1-3,6H,4-5,7-9H2,(H,19,21)(H,22,23)(H,24,25)
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1.90E+4n/an/an/an/an/an/a7.0n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of T cell protein tyrosine phosphatase (TC-PTP) at pH 7.0


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 2


(Homo sapiens (Human))
BDBM50118793
PNG
(6-Methyl-2-(oxalyl-amino)-4,5,6,7-tetrahydro-thien...)
Show SMILES CN1CCc2c(C1)sc(NC(=O)C(O)=O)c2C(O)=O
Show InChI InChI=1S/C11H12N2O5S/c1-13-3-2-5-6(4-13)19-9(7(5)10(15)16)12-8(14)11(17)18/h2-4H2,1H3,(H,12,14)(H,15,16)(H,17,18)
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2.20E+4n/an/an/an/an/an/a7.0n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of T cell protein tyrosine phosphatase (TC-PTP) at pH 7.0


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118742
PNG
(2-(Oxalyl-amino)-6-pyridin-2-ylmethyl-4,5,6,7-tetr...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(Cc3ccccn3)CCc2c1C(O)=O
Show InChI InChI=1S/C16H15N3O5S/c20-13(16(23)24)18-14-12(15(21)22)10-4-6-19(8-11(10)25-14)7-9-3-1-2-5-17-9/h1-3,5H,4,6-8H2,(H,18,20)(H,21,22)(H,23,24)
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2.30E+4n/an/an/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Protein-tyrosine phosphatase 1B.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 2


(Homo sapiens (Human))
BDBM50118774
PNG
(6-Benzyl-2-(oxalyl-amino)-4,5,6,7-tetrahydro-thien...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(Cc3ccccc3)CCc2c1C(O)=O
Show InChI InChI=1S/C17H16N2O5S/c20-14(17(23)24)18-15-13(16(21)22)11-6-7-19(9-12(11)25-15)8-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,18,20)(H,21,22)(H,23,24)
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2.40E+4n/an/an/an/an/an/a7.0n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of T cell protein tyrosine phosphatase (TC-PTP) at pH 7.0


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 2


(Homo sapiens (Human))
BDBM50118773
PNG
(6-Naphthalen-2-ylmethyl-2-(oxalyl-amino)-4,5,6,7-t...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(Cc3ccc4ccccc4c3)CCc2c1C(O)=O
Show InChI InChI=1S/C21H18N2O5S/c24-18(21(27)28)22-19-17(20(25)26)15-7-8-23(11-16(15)29-19)10-12-5-6-13-3-1-2-4-14(13)9-12/h1-6,9H,7-8,10-11H2,(H,22,24)(H,25,26)(H,27,28)
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3.40E+4n/an/an/an/an/an/a7.0n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibitory effect against inhibitory effect against T cell protein tyrosine phosphatase (TC-PTP) using p-nitrophenyl phosphate as substrate at pH 7.0


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118773
PNG
(6-Naphthalen-2-ylmethyl-2-(oxalyl-amino)-4,5,6,7-t...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(Cc3ccc4ccccc4c3)CCc2c1C(O)=O
Show InChI InChI=1S/C21H18N2O5S/c24-18(21(27)28)22-19-17(20(25)26)15-7-8-23(11-16(15)29-19)10-12-5-6-13-3-1-2-4-14(13)9-12/h1-6,9H,7-8,10-11H2,(H,22,24)(H,25,26)(H,27,28)
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4.20E+4n/an/an/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Protein-tyrosine phosphatase 1B.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 2


(Homo sapiens (Human))
BDBM50118742
PNG
(2-(Oxalyl-amino)-6-pyridin-2-ylmethyl-4,5,6,7-tetr...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(Cc3ccccn3)CCc2c1C(O)=O
Show InChI InChI=1S/C16H15N3O5S/c20-13(16(23)24)18-14-12(15(21)22)10-4-6-19(8-11(10)25-14)7-9-3-1-2-5-17-9/h1-3,5H,4,6-8H2,(H,18,20)(H,21,22)(H,23,24)
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4.80E+4n/an/an/an/an/an/a7.0n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibition of T cell protein tyrosine phosphatase (TC-PTP) at pH 7.0


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118774
PNG
(6-Benzyl-2-(oxalyl-amino)-4,5,6,7-tetrahydro-thien...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(Cc3ccccc3)CCc2c1C(O)=O
Show InChI InChI=1S/C17H16N2O5S/c20-14(17(23)24)18-15-13(16(21)22)11-6-7-19(9-12(11)25-15)8-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,18,20)(H,21,22)(H,23,24)
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6.31E+4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of PTP1B


J Med Chem 52: 3159-65 (2009)


Article DOI: 10.1021/jm801444x
BindingDB Entry DOI: 10.7270/Q2FF3TM8
More data for this
Ligand-Target Pair
Tyrosine-Protein Phosphatase (CD45)


(Homo sapiens (Human))
BDBM50118750
PNG
(2-(Oxalyl-amino)-6-phenethyl-4,5,6,7-tetrahydro-th...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCc3ccccc3)CCc2c1C(O)=O
Show InChI InChI=1S/C18H18N2O5S/c21-15(18(24)25)19-16-14(17(22)23)12-7-9-20(10-13(12)26-16)8-6-11-4-2-1-3-5-11/h1-5H,6-10H2,(H,19,21)(H,22,23)(H,24,25)
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1.40E+6n/an/an/an/an/an/a7.0n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibitory effect against human CD45 tyrosine phosphatase using p-nitrophenyl phosphate substrate at a pH 7.0


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase alpha


(Homo sapiens (Human))
BDBM50118750
PNG
(2-(Oxalyl-amino)-6-phenethyl-4,5,6,7-tetrahydro-th...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCc3ccccc3)CCc2c1C(O)=O
Show InChI InChI=1S/C18H18N2O5S/c21-15(18(24)25)19-16-14(17(22)23)12-7-9-20(10-13(12)26-16)8-6-11-4-2-1-3-5-11/h1-5H,6-10H2,(H,19,21)(H,22,23)(H,24,25)
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2.10E+6n/an/an/an/an/an/a7.0n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibitory effect against human Protein-tyrosine phosphatase alpha (PTPalpha) using p-nitrophenyl phosphate substrate at a pH 7.0


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein phosphatase F (LAR)


(Homo sapiens (Human))
BDBM50118750
PNG
(2-(Oxalyl-amino)-6-phenethyl-4,5,6,7-tetrahydro-th...)
Show SMILES OC(=O)C(=O)Nc1sc2CN(CCc3ccccc3)CCc2c1C(O)=O
Show InChI InChI=1S/C18H18N2O5S/c21-15(18(24)25)19-16-14(17(22)23)12-7-9-20(10-13(12)26-16)8-6-11-4-2-1-3-5-11/h1-5H,6-10H2,(H,19,21)(H,22,23)(H,24,25)
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2.10E+6n/an/an/an/an/an/a7.0n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibitory effect against human Protein-tyrosine phosphatase Lar using p-nitrophenyl phosphate substrate at a pH 7.0


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens (Human))
BDBM75221
PNG
(2-[(2,2-dimethyl-1-oxopropyl)amino]-6-(phenylmethy...)
Show SMILES COC(=O)c1c(NC(=O)C(C)(C)C)sc2CN(Cc3ccccc3)CCc12
Show InChI InChI=1S/C21H26N2O3S/c1-21(2,3)20(25)22-18-17(19(24)26-4)15-10-11-23(13-16(15)27-18)12-14-8-6-5-7-9-14/h5-9H,10-13H2,1-4H3,(H,22,25)
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n/an/an/an/a 2.17E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens (Human))
BDBM75215
PNG
(6-ethyl-2-[(1-oxo-2-phenylethyl)amino]-5,7-dihydro...)
Show SMILES CCN1CCc2c(C1)sc(NC(=O)Cc1ccccc1)c2C(=O)OC
Show InChI InChI=1S/C19H22N2O3S/c1-3-21-10-9-14-15(12-21)25-18(17(14)19(23)24-2)20-16(22)11-13-7-5-4-6-8-13/h4-8H,3,9-12H2,1-2H3,(H,20,22)
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n/an/an/an/a>5.00E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens (Human))
BDBM75223
PNG
(6-ethyl-2-[(1-oxo-2-phenylethyl)amino]-5,7-dihydro...)
Show SMILES CCOC(=O)c1c(NC(=O)Cc2ccccc2)sc2CN(CC)CCc12
Show InChI InChI=1S/C20H24N2O3S/c1-3-22-11-10-15-16(13-22)26-19(18(15)20(24)25-4-2)21-17(23)12-14-8-6-5-7-9-14/h5-9H,3-4,10-13H2,1-2H3,(H,21,23)
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n/an/an/an/a>5.00E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair