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Found 17 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)' AND taxid = 9606   
Target
(Institution)
LigandTarget
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 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM50436358
PNG
(CHEMBL2396718)
Show SMILES CCCNC(=O)COc1ccc(cc1)-c1oc2cc(O)c(cc2c1C#Cc1cccc(Cl)c1)C(O)=O
Show InChI InChI=1S/C28H22ClNO6/c1-2-12-30-26(32)16-35-20-9-7-18(8-10-20)27-21(11-6-17-4-3-5-19(29)13-17)22-14-23(28(33)34)24(31)15-25(22)36-27/h3-5,7-10,13-15,31H,2,12,16H2,1H3,(H,30,32)(H,33,34)
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n/an/a 800n/an/an/an/an/an/a



Indiana University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of recombinant PTP-PEST (unknown origin) using pNPP as substrate by spectrophotometric analysis


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM50079855
PNG
((R)-2-[2,6-Dibromo-4-(6-bromo-benzo[b]naphtho[2,3-...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)Oc1c(Br)cc(cc1Br)-c1c2c3ccccc3oc2c(Br)c2ccccc12
Show InChI InChI=1S/C31H19Br3O4/c32-22-15-18(16-23(33)29(22)38-25(31(35)36)14-17-8-2-1-3-9-17)26-19-10-4-5-11-20(19)28(34)30-27(26)21-12-6-7-13-24(21)37-30/h1-13,15-16,25H,14H2,(H,35,36)/t25-/m1/s1
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n/an/a 2.20E+3n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
The compound was tested in vitro for the inhibitory activity against Protein tyrosine phosphatase PEST (SH-PTP1) (human PTPases.)


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM50079856
PNG
(CHEMBL108721 | [2,6-Dibromo-4-(6-bromo-benzo[b]nap...)
Show SMILES OC(=O)COc1c(Br)cc(cc1Br)-c1c2c(sc3ccccc23)c(Br)c2ccccc12
Show InChI InChI=1S/C24H13Br3O3S/c25-16-9-12(10-17(26)23(16)30-11-19(28)29)20-13-5-1-2-6-14(13)22(27)24-21(20)15-7-3-4-8-18(15)31-24/h1-10H,11H2,(H,28,29)
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n/an/a 2.30E+3n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
The compound was tested in vitro for the inhibitory activity against Protein tyrosine phosphatase PEST (SH-PTP1) (human PTPases.)


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM50436357
PNG
(CHEMBL2396719)
Show SMILES OC(=O)c1cc2c(C#Cc3cccc(Cl)c3)c(oc2cc1O)-c1ccc(OCC(=O)NC2CC2)cc1
Show InChI InChI=1S/C28H20ClNO6/c29-18-3-1-2-16(12-18)4-11-21-22-13-23(28(33)34)24(31)14-25(22)36-27(21)17-5-9-20(10-6-17)35-15-26(32)30-19-7-8-19/h1-3,5-6,9-10,12-14,19,31H,7-8,15H2,(H,30,32)(H,33,34)
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n/an/a 2.40E+3n/an/an/an/an/an/a



Indiana University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of recombinant PTP-PEST (unknown origin) using pNPP as substrate by spectrophotometric analysis


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM231167
PNG
(US9340574, 7)
Show SMILES COc1cc(CC(=O)NCC(NC(=O)C(CCCNC(=O)c2cccc(I)c2)NC(=O)C(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)NC(=O)c2ccc(C)c(Br)c2)C(N)=O)ccc1O
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US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
PTP activity was assayed using p-nitrophenyl phosphate (pNPP) as a substrate in 3,3-dimethylglutarate buffer (50 mM 3,3-dimethylglutarate, pH 7.0, 1 ...


US Patent US9340574 (2016)

More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM50393492
PNG
(CHEMBL2159933)
Show SMILES Cc1ccc2sc(NC(=O)c3sc4ccccc4c3Cl)nc2c1
Show InChI InChI=1S/C17H11ClN2OS2/c1-9-6-7-13-11(8-9)19-17(23-13)20-16(21)15-14(18)10-4-2-3-5-12(10)22-15/h2-8H,1H3,(H,19,20,21)
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n/an/a 1.40E+4n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibition of PTP-PEST expressed in Escherichia coli BL21 using pNPP substrate


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM50393491
PNG
(CHEMBL2159932)
Show SMILES CCOc1ccc(NC(=O)CSc2nc3c(C)cc(C)cc3cc2C#N)cc1
Show InChI InChI=1S/C22H21N3O2S/c1-4-27-19-7-5-18(6-8-19)24-20(26)13-28-22-17(12-23)11-16-10-14(2)9-15(3)21(16)25-22/h5-11H,4,13H2,1-3H3,(H,24,26)
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n/an/a 1.60E+4n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibition of PTP-PEST expressed in Escherichia coli BL21 using pNPP substrate


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM50393493
PNG
(CHEMBL2159934)
Show SMILES COc1ccc2cc(C#N)c(SCC(=O)Nc3cccc(C)c3C)nc2c1
Show InChI InChI=1S/C21H19N3O2S/c1-13-5-4-6-18(14(13)2)23-20(25)12-27-21-16(11-22)9-15-7-8-17(26-3)10-19(15)24-21/h4-10H,12H2,1-3H3,(H,23,25)
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n/an/a 1.80E+4n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibition of PTP-PEST expressed in Escherichia coli BL21 using pNPP substrate


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM50393495
PNG
(CHEMBL2159725)
Show SMILES CCOc1ccc2nc(NC(=O)CSc3nc4sc(C)c(C)c4c(=O)[nH]3)sc2c1
Show InChI InChI=1S/C19H18N4O3S3/c1-4-26-11-5-6-12-13(7-11)29-19(20-12)21-14(24)8-27-18-22-16(25)15-9(2)10(3)28-17(15)23-18/h5-7H,4,8H2,1-3H3,(H,20,21,24)(H,22,23,25)
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n/an/a 2.00E+4n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibition of PTP-PEST expressed in Escherichia coli BL21 using pNPP substrate


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM50393500
PNG
(CHEMBL2159726)
Show SMILES Cc1ccc2cc(C#N)c(SCC(=O)NC3CCCCC3)nc2c1C
Show InChI InChI=1S/C20H23N3OS/c1-13-8-9-15-10-16(11-21)20(23-19(15)14(13)2)25-12-18(24)22-17-6-4-3-5-7-17/h8-10,17H,3-7,12H2,1-2H3,(H,22,24)
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n/an/a 2.10E+4n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibition of PTP-PEST expressed in Escherichia coli BL21 using pNPP substrate


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM50393498
PNG
(CHEMBL2159930)
Show SMILES Cc1ccc(NC(=O)CSc2nc3c(C)c(C)ccc3cc2C#N)cc1C
Show InChI InChI=1S/C22H21N3OS/c1-13-6-8-19(9-15(13)3)24-20(26)12-27-22-18(11-23)10-17-7-5-14(2)16(4)21(17)25-22/h5-10H,12H2,1-4H3,(H,24,26)
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n/an/a 2.75E+4n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibition of PTP-PEST expressed in Escherichia coli BL21 using pNPP substrate


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM50393499
PNG
(CHEMBL2159931)
Show SMILES Cc1cccc2cc(C#N)c(SCC(=O)Nc3cccc(Cl)c3)nc12
Show InChI InChI=1S/C19H14ClN3OS/c1-12-4-2-5-13-8-14(10-21)19(23-18(12)13)25-11-17(24)22-16-7-3-6-15(20)9-16/h2-9H,11H2,1H3,(H,22,24)
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n/an/a 2.80E+4n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibition of PTP-PEST expressed in Escherichia coli BL21 using pNPP substrate


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM54792
PNG
(2-(3-cyano-5,8-dimethyl-quinolin-2-yl)sulfanyl-N-(...)
Show SMILES CCc1cccc(C)c1NC(=O)CSc1nc2c(C)ccc(C)c2cc1C#N
Show InChI InChI=1S/C23H23N3OS/c1-5-17-8-6-7-15(3)21(17)25-20(27)13-28-23-18(12-24)11-19-14(2)9-10-16(4)22(19)26-23/h6-11H,5,13H2,1-4H3,(H,25,27)
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n/an/a 3.50E+4n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibition of PTP-PEST expressed in Escherichia coli BL21 using pNPP substrate


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM50393502
PNG
(CHEMBL2159929)
Show SMILES Cc1ccc2cc(C#N)c(SCC(=O)Nc3ccc4OCOc4c3)nc2c1
Show InChI InChI=1S/C20H15N3O3S/c1-12-2-3-13-7-14(9-21)20(23-16(13)6-12)27-10-19(24)22-15-4-5-17-18(8-15)26-11-25-17/h2-8H,10-11H2,1H3,(H,22,24)
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n/an/a 3.60E+4n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibition of PTP-PEST expressed in Escherichia coli BL21 using pNPP substrate


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM46265
PNG
(2-[(2-cyclopropyl-5,6,7,8-tetrahydrobenzothiopheno...)
Show SMILES O=C(CSc1nc(nc2sc3CCCCc3c12)C1CC1)NCc1ccc2OCOc2c1
Show InChI InChI=1S/C23H23N3O3S2/c27-19(24-10-13-5-8-16-17(9-13)29-12-28-16)11-30-22-20-15-3-1-2-4-18(15)31-23(20)26-21(25-22)14-6-7-14/h5,8-9,14H,1-4,6-7,10-12H2,(H,24,27)
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n/an/a 3.90E+4n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibition of PTP-PEST expressed in Escherichia coli BL21 using pNPP substrate


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM46264
PNG
(3-[2-azaspiro[5.5]undecan-2-yl-(1-cyclopentyl-1,2,...)
Show SMILES Cc1ccc2[nH]c(=O)c(cc2c1)C(N1CCCC2(CCCCC2)C1)c1nnnn1C1CCCC1
Show InChI InChI=1S/C27H36N6O/c1-19-10-11-23-20(16-19)17-22(26(34)28-23)24(25-29-30-31-33(25)21-8-3-4-9-21)32-15-7-14-27(18-32)12-5-2-6-13-27/h10-11,16-17,21,24H,2-9,12-15,18H2,1H3,(H,28,34)
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n/an/a>4.00E+4n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibition of PTP-PEST expressed in Escherichia coli BL21 using pNPP substrate


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)


(Homo sapiens (Human))
BDBM50393501
PNG
(CHEMBL2159928)
Show SMILES COc1ccc(cc1)-n1ncc2c(SCC(=O)N3C(C)Cc4ccccc34)ncnc12
Show InChI InChI=1S/C23H21N5O2S/c1-15-11-16-5-3-4-6-20(16)27(15)21(29)13-31-23-19-12-26-28(22(19)24-14-25-23)17-7-9-18(30-2)10-8-17/h3-10,12,14-15H,11,13H2,1-2H3
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n/an/a>4.00E+4n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibition of PTP-PEST expressed in Escherichia coli BL21 using pNPP substrate


Citation and Details
More data for this
Ligand-Target Pair