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Compile Data Set for Download or QSAR

Found 82 hits Enz. Inhib. hit(s) with all data for entry = 50033261   
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
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342301
PNG
(2-(2-(benzo[b]thiophen-3-yl)acetamido)thiophene-3-...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1csc2ccccc12
Show InChI InChI=1S/C15H12N2O2S2/c16-14(19)11-5-6-20-15(11)17-13(18)7-9-8-21-12-4-2-1-3-10(9)12/h1-6,8H,7H2,(H2,16,19)(H,17,18)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342302
PNG
(2-(2-(2-chlorophenyl)acetamido)thiophene-3-carboxa...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccccc1Cl
Show InChI InChI=1S/C13H11ClN2O2S/c14-10-4-2-1-3-8(10)7-11(17)16-13-9(12(15)18)5-6-19-13/h1-6H,7H2,(H2,15,18)(H,16,17)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342303
PNG
(2-(2-(benzo[d][1,3]dioxol-5-yl)acetamido)thiophene...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccc2OCOc2c1
Show InChI InChI=1S/C14H12N2O4S/c15-13(18)9-3-4-21-14(9)16-12(17)6-8-1-2-10-11(5-8)20-7-19-10/h1-5H,6-7H2,(H2,15,18)(H,16,17)
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n/an/a 1.80E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342304
PNG
(2-(2-(3-bromophenyl)acetamido)thiophene-3-carboxam...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1cccc(Br)c1
Show InChI InChI=1S/C13H11BrN2O2S/c14-9-3-1-2-8(6-9)7-11(17)16-13-10(12(15)18)4-5-19-13/h1-6H,7H2,(H2,15,18)(H,16,17)
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n/an/a 1.80E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342305
PNG
(2-(2-(3-iodophenyl)acetamido)thiophene-3-carboxami...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1cccc(I)c1
Show InChI InChI=1S/C13H11IN2O2S/c14-9-3-1-2-8(6-9)7-11(17)16-13-10(12(15)18)4-5-19-13/h1-6H,7H2,(H2,15,18)(H,16,17)
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n/an/a 1.80E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342306
PNG
(2-(2-(4-ethoxyphenyl)acetamido)thiophene-3-carboxa...)
Show SMILES CCOc1ccc(CC(=O)Nc2sccc2C(N)=O)cc1
Show InChI InChI=1S/C15H16N2O3S/c1-2-20-11-5-3-10(4-6-11)9-13(18)17-15-12(14(16)19)7-8-21-15/h3-8H,2,9H2,1H3,(H2,16,19)(H,17,18)
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n/an/a 1.90E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342307
PNG
(2-(2-(9-chloro-3,4-dihydro-2H-benzo[b][1,4]dioxepi...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1cc(Cl)c2OCCCOc2c1
Show InChI InChI=1S/C16H15ClN2O4S/c17-11-6-9(7-12-14(11)23-4-1-3-22-12)8-13(20)19-16-10(15(18)21)2-5-24-16/h2,5-7H,1,3-4,8H2,(H2,18,21)(H,19,20)
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n/an/a 1.90E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342308
PNG
(2-(2-(2-methoxy-5-methylphenyl)acetamido)thiophene...)
Show SMILES COc1ccc(C)cc1CC(=O)Nc1sccc1C(N)=O
Show InChI InChI=1S/C15H16N2O3S/c1-9-3-4-12(20-2)10(7-9)8-13(18)17-15-11(14(16)19)5-6-21-15/h3-7H,8H2,1-2H3,(H2,16,19)(H,17,18)
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n/an/a 2.30E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342310
PNG
(2-(2-(6-(thiophen-2-yl)imidazo[2,1-b]thiazol-3-yl)...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1csc2nc(cn12)-c1cccs1
Show InChI InChI=1S/C16H12N4O2S3/c17-14(22)10-3-5-24-15(10)19-13(21)6-9-8-25-16-18-11(7-20(9)16)12-2-1-4-23-12/h1-5,7-8H,6H2,(H2,17,22)(H,19,21)
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n/an/a 2.50E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342309
PNG
(2-(2-(2,3-dihydro-1H-inden-5-yl)acetamido)thiophen...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccc2CCCc2c1
Show InChI InChI=1S/C16H16N2O2S/c17-15(20)13-6-7-21-16(13)18-14(19)9-10-4-5-11-2-1-3-12(11)8-10/h4-8H,1-3,9H2,(H2,17,20)(H,18,19)
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n/an/a 2.50E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342311
PNG
(2-(2-(5-methylimidazo[2,1-b]thiazol-2-yl)acetamido...)
Show SMILES Cc1cnc2sc(CC(=O)Nc3sccc3C(N)=O)cn12
Show InChI InChI=1S/C13H12N4O2S2/c1-7-5-15-13-17(7)6-8(21-13)4-10(18)16-12-9(11(14)19)2-3-20-12/h2-3,5-6H,4H2,1H3,(H2,14,19)(H,16,18)
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n/an/a 2.50E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342312
PNG
(2-(2-(3-chlorophenyl)acetamido)thiophene-3-carboxa...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1cccc(Cl)c1
Show InChI InChI=1S/C13H11ClN2O2S/c14-9-3-1-2-8(6-9)7-11(17)16-13-10(12(15)18)4-5-19-13/h1-6H,7H2,(H2,15,18)(H,16,17)
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n/an/a 2.60E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342313
PNG
(2-(2-(3-methoxyphenyl)acetamido)thiophene-3-carbox...)
Show SMILES COc1cccc(CC(=O)Nc2sccc2C(N)=O)c1
Show InChI InChI=1S/C14H14N2O3S/c1-19-10-4-2-3-9(7-10)8-12(17)16-14-11(13(15)18)5-6-20-14/h2-7H,8H2,1H3,(H2,15,18)(H,16,17)
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n/an/a 2.60E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342314
PNG
(2-(2-(3,5-dimethylphenyl)acetamido)thiophene-3-car...)
Show SMILES Cc1cc(C)cc(CC(=O)Nc2sccc2C(N)=O)c1
Show InChI InChI=1S/C15H16N2O2S/c1-9-5-10(2)7-11(6-9)8-13(18)17-15-12(14(16)19)3-4-20-15/h3-7H,8H2,1-2H3,(H2,16,19)(H,17,18)
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n/an/a 2.70E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342315
PNG
(2-(2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamid...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccc2OCCOc2c1
Show InChI InChI=1S/C15H14N2O4S/c16-14(19)10-3-6-22-15(10)17-13(18)8-9-1-2-11-12(7-9)21-5-4-20-11/h1-3,6-7H,4-5,8H2,(H2,16,19)(H,17,18)
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n/an/a 2.70E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342316
PNG
(2-(2-(2-bromophenyl)acetamido)thiophene-3-carboxam...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccccc1Br
Show InChI InChI=1S/C13H11BrN2O2S/c14-10-4-2-1-3-8(10)7-11(17)16-13-9(12(15)18)5-6-19-13/h1-6H,7H2,(H2,15,18)(H,16,17)
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n/an/a 2.90E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342317
PNG
(2-(2-(4-nitrophenyl)acetamido)thiophene-3-carboxam...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C13H11N3O4S/c14-12(18)10-5-6-21-13(10)15-11(17)7-8-1-3-9(4-2-8)16(19)20/h1-6H,7H2,(H2,14,18)(H,15,17)
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n/an/a 2.90E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342318
PNG
(2-(2-(3,5-dimethoxyphenyl)acetamido)thiophene-3-ca...)
Show SMILES COc1cc(CC(=O)Nc2sccc2C(N)=O)cc(OC)c1
Show InChI InChI=1S/C15H16N2O4S/c1-20-10-5-9(6-11(8-10)21-2)7-13(18)17-15-12(14(16)19)3-4-22-15/h3-6,8H,7H2,1-2H3,(H2,16,19)(H,17,18)
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n/an/a 3.10E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342319
PNG
(2-(2-(thiophen-2-yl)acetamido)thiophene-3-carboxam...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1cccs1
Show InChI InChI=1S/C11H10N2O2S2/c12-10(15)8-3-5-17-11(8)13-9(14)6-7-2-1-4-16-7/h1-5H,6H2,(H2,12,15)(H,13,14)
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n/an/a 3.20E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342320
PNG
(2-(2-(2-iodophenyl)acetamido)thiophene-3-carboxami...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccccc1I
Show InChI InChI=1S/C13H11IN2O2S/c14-10-4-2-1-3-8(10)7-11(17)16-13-9(12(15)18)5-6-19-13/h1-6H,7H2,(H2,15,18)(H,16,17)
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n/an/a 3.40E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342321
PNG
(2-(2-(4-cyanophenyl)acetamido)thiophene-3-carboxam...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccc(cc1)C#N
Show InChI InChI=1S/C14H11N3O2S/c15-8-10-3-1-9(2-4-10)7-12(18)17-14-11(13(16)19)5-6-20-14/h1-6H,7H2,(H2,16,19)(H,17,18)
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n/an/a 3.40E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342322
PNG
(2-(2-phenylacetamido)thiophene-3-carboxamide | CHE...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccccc1
Show InChI InChI=1S/C13H12N2O2S/c14-12(17)10-6-7-18-13(10)15-11(16)8-9-4-2-1-3-5-9/h1-7H,8H2,(H2,14,17)(H,15,16)
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n/an/a 3.60E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342323
PNG
(2-(2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamido)...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccc2CCCCc2c1
Show InChI InChI=1S/C17H18N2O2S/c18-16(21)14-7-8-22-17(14)19-15(20)10-11-5-6-12-3-1-2-4-13(12)9-11/h5-9H,1-4,10H2,(H2,18,21)(H,19,20)
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n/an/a 3.60E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342324
PNG
(2-(2-p-tolylacetamido)thiophene-3-carboxamide | CH...)
Show SMILES Cc1ccc(CC(=O)Nc2sccc2C(N)=O)cc1
Show InChI InChI=1S/C14H14N2O2S/c1-9-2-4-10(5-3-9)8-12(17)16-14-11(13(15)18)6-7-19-14/h2-7H,8H2,1H3,(H2,15,18)(H,16,17)
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n/an/a 4.30E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342301
PNG
(2-(2-(benzo[b]thiophen-3-yl)acetamido)thiophene-3-...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1csc2ccccc12
Show InChI InChI=1S/C15H12N2O2S2/c16-14(19)11-5-6-20-15(11)17-13(18)7-9-8-21-12-4-2-1-3-10(9)12/h1-6,8H,7H2,(H2,16,19)(H,17,18)
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n/an/a 4.62E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Displacement of biotin-labeled JIP1 peptide from JNK1 by DELFIA assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342325
PNG
(2-(2-(6-fluoro-4H-benzo[d][1,3]dioxin-8-yl)acetami...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1cc(F)cc2COCOc12
Show InChI InChI=1S/C15H13FN2O4S/c16-10-3-8(13-9(4-10)6-21-7-22-13)5-12(19)18-15-11(14(17)20)1-2-23-15/h1-4H,5-7H2,(H2,17,20)(H,18,19)
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n/an/a 4.90E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342326
PNG
(2-(2-(4-fluorophenyl)acetamido)thiophene-3-carboxa...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccc(F)cc1
Show InChI InChI=1S/C13H11FN2O2S/c14-9-3-1-8(2-4-9)7-11(17)16-13-10(12(15)18)5-6-19-13/h1-6H,7H2,(H2,15,18)(H,16,17)
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n/an/a 5.10E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342327
PNG
(2-(2-(naphthalen-1-yl)acetamido)thiophene-3-carbox...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1cccc2ccccc12
Show InChI InChI=1S/C17H14N2O2S/c18-16(21)14-8-9-22-17(14)19-15(20)10-12-6-3-5-11-4-1-2-7-13(11)12/h1-9H,10H2,(H2,18,21)(H,19,20)
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n/an/a 5.40E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342328
PNG
(2-(2-m-tolylacetamido)thiophene-3-carboxamide | CH...)
Show SMILES Cc1cccc(CC(=O)Nc2sccc2C(N)=O)c1
Show InChI InChI=1S/C14H14N2O2S/c1-9-3-2-4-10(7-9)8-12(17)16-14-11(13(15)18)5-6-19-14/h2-7H,8H2,1H3,(H2,15,18)(H,16,17)
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n/an/a 5.40E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342329
PNG
(2-(2-(4-methoxyphenyl)acetamido)thiophene-3-carbox...)
Show SMILES COc1ccc(CC(=O)Nc2sccc2C(N)=O)cc1
Show InChI InChI=1S/C14H14N2O3S/c1-19-10-4-2-9(3-5-10)8-12(17)16-14-11(13(15)18)6-7-20-14/h2-7H,8H2,1H3,(H2,15,18)(H,16,17)
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n/an/a 5.70E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342330
PNG
(2-(2-(4-(trifluoromethoxy)phenyl)acetamido)thiophe...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C14H11F3N2O3S/c15-14(16,17)22-9-3-1-8(2-4-9)7-11(20)19-13-10(12(18)21)5-6-23-13/h1-6H,7H2,(H2,18,21)(H,19,20)
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n/an/a 5.80E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342331
PNG
(2-(2-(2,5-difluorophenyl)acetamido)thiophene-3-car...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1cc(F)ccc1F
Show InChI InChI=1S/C13H10F2N2O2S/c14-8-1-2-10(15)7(5-8)6-11(18)17-13-9(12(16)19)3-4-20-13/h1-5H,6H2,(H2,16,19)(H,17,18)
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n/an/a 5.80E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342332
PNG
(2-benzamidothiophene-3-carboxamide | CHEMBL1767238)
Show SMILES NC(=O)c1ccsc1NC(=O)c1ccccc1
Show InChI InChI=1S/C12H10N2O2S/c13-10(15)9-6-7-17-12(9)14-11(16)8-4-2-1-3-5-8/h1-7H,(H2,13,15)(H,14,16)
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n/an/a 5.90E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342333
PNG
(2-(2-o-tolylacetamido)thiophene-3-carboxamide | CH...)
Show SMILES Cc1ccccc1CC(=O)Nc1sccc1C(N)=O
Show InChI InChI=1S/C14H14N2O2S/c1-9-4-2-3-5-10(9)8-12(17)16-14-11(13(15)18)6-7-19-14/h2-7H,8H2,1H3,(H2,15,18)(H,16,17)
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n/an/a 6.00E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342334
PNG
(2-(2-(4-(trifluoromethyl)phenyl)acetamido)thiophen...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C14H11F3N2O2S/c15-14(16,17)9-3-1-8(2-4-9)7-11(20)19-13-10(12(18)21)5-6-22-13/h1-6H,7H2,(H2,18,21)(H,19,20)
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n/an/a 6.40E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342335
PNG
(2-(2-(2,6-difluorophenyl)acetamido)thiophene-3-car...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1c(F)cccc1F
Show InChI InChI=1S/C13H10F2N2O2S/c14-9-2-1-3-10(15)8(9)6-11(18)17-13-7(12(16)19)4-5-20-13/h1-5H,6H2,(H2,16,19)(H,17,18)
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n/an/a 7.40E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Transcription factor Jun


(Homo sapiens (Human))
BDBM50342301
PNG
(2-(2-(benzo[b]thiophen-3-yl)acetamido)thiophene-3-...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1csc2ccccc12
Show InChI InChI=1S/C15H12N2O2S2/c16-14(19)11-5-6-20-15(11)17-13(18)7-9-8-21-12-4-2-1-3-10(9)12/h1-6,8H,7H2,(H2,16,19)(H,17,18)
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n/an/a 7.50E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TNFalpha-induced c-Jun phosphorylation in human HeLa cells by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342336
PNG
(2-(2-(3-(trifluoromethyl)phenyl)acetamido)thiophen...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C14H11F3N2O2S/c15-14(16,17)9-3-1-2-8(6-9)7-11(20)19-13-10(12(18)21)4-5-22-13/h1-6H,7H2,(H2,18,21)(H,19,20)
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n/an/a 7.60E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342337
PNG
(2-(2-(4-(furan-2-ylmethyl)piperazin-1-yl)acetamido...)
Show SMILES NC(=O)c1ccsc1NC(=O)CN1CCN(Cc2ccco2)CC1
Show InChI InChI=1S/C16H20N4O3S/c17-15(22)13-3-9-24-16(13)18-14(21)11-20-6-4-19(5-7-20)10-12-2-1-8-23-12/h1-3,8-9H,4-7,10-11H2,(H2,17,22)(H,18,21)
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n/an/a 7.60E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342338
PNG
(2-(2-(pyridin-3-yl)acetamido)thiophene-3-carboxami...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1cccnc1
Show InChI InChI=1S/C12H11N3O2S/c13-11(17)9-3-5-18-12(9)15-10(16)6-8-2-1-4-14-7-8/h1-5,7H,6H2,(H2,13,17)(H,15,16)
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n/an/a 8.10E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342339
PNG
(2-(2-(3,5-difluorophenyl)acetamido)thiophene-3-car...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1cc(F)cc(F)c1
Show InChI InChI=1S/C13H10F2N2O2S/c14-8-3-7(4-9(15)6-8)5-11(18)17-13-10(12(16)19)1-2-20-13/h1-4,6H,5H2,(H2,16,19)(H,17,18)
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n/an/a 8.20E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342340
PNG
(2-(2-(2-fluorophenyl)acetamido)thiophene-3-carboxa...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccccc1F
Show InChI InChI=1S/C13H11FN2O2S/c14-10-4-2-1-3-8(10)7-11(17)16-13-9(12(15)18)5-6-19-13/h1-6H,7H2,(H2,15,18)(H,16,17)
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n/an/a 8.30E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342341
PNG
(2-(2-(3-fluorophenyl)acetamido)thiophene-3-carboxa...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1cccc(F)c1
Show InChI InChI=1S/C13H11FN2O2S/c14-9-3-1-2-8(6-9)7-11(17)16-13-10(12(15)18)4-5-19-13/h1-6H,7H2,(H2,15,18)(H,16,17)
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n/an/a 9.40E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342342
PNG
(2-(2-(1H-indol-3-yl)acetamido)thiophene-3-carboxam...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C15H13N3O2S/c16-14(20)11-5-6-21-15(11)18-13(19)7-9-8-17-12-4-2-1-3-10(9)12/h1-6,8,17H,7H2,(H2,16,20)(H,18,19)
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n/an/a 9.40E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342343
PNG
(2-(2-(2,4-difluorophenyl)acetamido)thiophene-3-car...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccc(F)cc1F
Show InChI InChI=1S/C13H10F2N2O2S/c14-8-2-1-7(10(15)6-8)5-11(18)17-13-9(12(16)19)3-4-20-13/h1-4,6H,5H2,(H2,16,19)(H,17,18)
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n/an/a 9.70E+3n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342344
PNG
(2-(2-(3,4-difluorophenyl)acetamido)thiophene-3-car...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccc(F)c(F)c1
Show InChI InChI=1S/C13H10F2N2O2S/c14-9-2-1-7(5-10(9)15)6-11(18)17-13-8(12(16)19)3-4-20-13/h1-5H,6H2,(H2,16,19)(H,17,18)
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n/an/a 1.02E+4n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342345
PNG
(2-(2-(2-methoxyphenyl)acetamido)thiophene-3-carbox...)
Show SMILES COc1ccccc1CC(=O)Nc1sccc1C(N)=O
Show InChI InChI=1S/C14H14N2O3S/c1-19-11-5-3-2-4-9(11)8-12(17)16-14-10(13(15)18)6-7-20-14/h2-7H,8H2,1H3,(H2,15,18)(H,16,17)
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n/an/a 1.19E+4n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342346
PNG
(2-(2-(2-chloro-6-fluorophenyl)acetamido)thiophene-...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1c(F)cccc1Cl
Show InChI InChI=1S/C13H10ClFN2O2S/c14-9-2-1-3-10(15)8(9)6-11(18)17-13-7(12(16)19)4-5-20-13/h1-5H,6H2,(H2,16,19)(H,17,18)
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n/an/a 1.25E+4n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342347
PNG
(2-(2-(4-chlorophenyl)acetamido)thiophene-3-carboxa...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C13H11ClN2O2S/c14-9-3-1-8(2-4-9)7-11(17)16-13-10(12(15)18)5-6-19-13/h1-6H,7H2,(H2,15,18)(H,16,17)
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n/an/a 1.87E+4n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50342348
PNG
(2-(2-(3-cyanophenyl)acetamido)thiophene-3-carboxam...)
Show SMILES NC(=O)c1ccsc1NC(=O)Cc1cccc(c1)C#N
Show InChI InChI=1S/C14H11N3O2S/c15-8-10-3-1-2-9(6-10)7-12(18)17-14-11(13(16)19)4-5-20-14/h1-6H,7H2,(H2,16,19)(H,17,18)
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n/an/a 2.09E+4n/an/an/an/an/an/a



Sanford-Burnham Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of JNK1 by TR-FRET assay


Bioorg Med Chem 19: 2582-8 (2011)


Article DOI: 10.1016/j.bmc.2011.03.017
BindingDB Entry DOI: 10.7270/Q2J966PD
More data for this
Ligand-Target Pair
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