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Compile Data Set for Download or QSAR

Found 110 hits with Last Name = 'muth' and Initial = 'f'   
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 10


(Homo sapiens (Human))
BDBM50234890
PNG
(CHEMBL4077018)
Show SMILES CSc1nc(c(-c2ccnc(Nc3ccc(NC(=O)c4cccc(NC(=O)C=C)c4)cc3)c2)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C32H27FN6O2S/c1-4-28(40)36-26-7-5-6-22(18-26)31(41)37-25-14-12-24(13-15-25)35-27-19-21(16-17-34-27)30-29(38-32(42-3)39(30)2)20-8-10-23(33)11-9-20/h4-19H,1H2,2-3H3,(H,34,35)(H,36,40)(H,37,41)
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n/an/a 0.300n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234889
PNG
(CHEMBL4062023)
Show SMILES CSc1nc(c([nH]1)-c1ccnc(Nc2ccc(NC(=O)c3cccc(NC(=O)C=C)c3)cc2)c1)-c1ccc(F)cc1
Show InChI InChI=1S/C31H25FN6O2S/c1-3-27(39)35-25-6-4-5-21(17-25)30(40)36-24-13-11-23(12-14-24)34-26-18-20(15-16-33-26)29-28(37-31(38-29)41-2)19-7-9-22(32)10-8-19/h3-18H,1H2,2H3,(H,33,34)(H,35,39)(H,36,40)(H,37,38)
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n/an/a 0.600n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50234889
PNG
(CHEMBL4062023)
Show SMILES CSc1nc(c([nH]1)-c1ccnc(Nc2ccc(NC(=O)c3cccc(NC(=O)C=C)c3)cc2)c1)-c1ccc(F)cc1
Show InChI InChI=1S/C31H25FN6O2S/c1-3-27(39)35-25-6-4-5-21(17-25)30(40)36-24-13-11-23(12-14-24)34-26-18-20(15-16-33-26)29-28(37-31(38-29)41-2)19-7-9-22(32)10-8-19/h3-18H,1H2,2H3,(H,33,34)(H,35,39)(H,36,40)(H,37,38)
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n/an/a 0.800n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of GST-His tagged human p38alpha expressed in Escherichia coli assessed as reduction in ATF2 phosphorylation measured after 60 mins by ELI...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234880
PNG
(CHEMBL4086457)
Show SMILES CSc1nc(c(-c2ccnc(Nc3ccc(NC(=O)c4cccc(NC(=O)C=C)c4C)cc3)c2)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C33H29FN6O2S/c1-5-29(41)38-27-8-6-7-26(20(27)2)32(42)37-25-15-13-24(14-16-25)36-28-19-22(17-18-35-28)31-30(39-33(43-4)40(31)3)21-9-11-23(34)12-10-21/h5-19H,1H2,2-4H3,(H,35,36)(H,37,42)(H,38,41)
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n/an/a 2n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50234880
PNG
(CHEMBL4086457)
Show SMILES CSc1nc(c(-c2ccnc(Nc3ccc(NC(=O)c4cccc(NC(=O)C=C)c4C)cc3)c2)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C33H29FN6O2S/c1-5-29(41)38-27-8-6-7-26(20(27)2)32(42)37-25-15-13-24(14-16-25)36-28-19-22(17-18-35-28)31-30(39-33(43-4)40(31)3)21-9-11-23(34)12-10-21/h5-19H,1H2,2-4H3,(H,35,36)(H,37,42)(H,38,41)
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n/an/a 2n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of GST-His tagged human p38alpha expressed in Escherichia coli assessed as reduction in ATF2 phosphorylation measured after 60 mins by ELI...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234886
PNG
(CHEMBL4082278)
Show SMILES CSc1nc(C)c([nH]1)-c1ccnc(Nc2ccc(NC(=O)c3cccc(NC(=O)C=C)c3)cc2)c1
Show InChI InChI=1S/C26H24N6O2S/c1-4-23(33)30-21-7-5-6-18(14-21)25(34)31-20-10-8-19(9-11-20)29-22-15-17(12-13-27-22)24-16(2)28-26(32-24)35-3/h4-15H,1H2,2-3H3,(H,27,29)(H,28,32)(H,30,33)(H,31,34)
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n/an/a 2n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234885
PNG
(CHEMBL4092555)
Show SMILES CSc1nc(c(-c2ccnc(Nc3ccc(NC(=O)c4cccc(NC(=O)C=C)c4)cc3C)c2)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C33H29FN6O2S/c1-5-29(41)36-25-8-6-7-23(18-25)32(42)37-26-13-14-27(20(2)17-26)38-28-19-22(15-16-35-28)31-30(39-33(43-4)40(31)3)21-9-11-24(34)12-10-21/h5-19H,1H2,2-4H3,(H,35,38)(H,36,41)(H,37,42)
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n/an/a 2n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234883
PNG
(CHEMBL4069805)
Show SMILES CCC(=O)Nc1cccc(c1)C(=O)Nc1ccc(Nc2cc(ccn2)-c2[nH]c(SC)nc2-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C31H27FN6O2S/c1-3-27(39)35-25-6-4-5-21(17-25)30(40)36-24-13-11-23(12-14-24)34-26-18-20(15-16-33-26)29-28(37-31(38-29)41-2)19-7-9-22(32)10-8-19/h4-18H,3H2,1-2H3,(H,33,34)(H,35,39)(H,36,40)(H,37,38)
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n/an/a 2n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50234885
PNG
(CHEMBL4092555)
Show SMILES CSc1nc(c(-c2ccnc(Nc3ccc(NC(=O)c4cccc(NC(=O)C=C)c4)cc3C)c2)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C33H29FN6O2S/c1-5-29(41)36-25-8-6-7-23(18-25)32(42)37-26-13-14-27(20(2)17-26)38-28-19-22(15-16-35-28)31-30(39-33(43-4)40(31)3)21-9-11-24(34)12-10-21/h5-19H,1H2,2-4H3,(H,35,38)(H,36,41)(H,37,42)
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n/an/a 3n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of GST-His tagged human p38alpha expressed in Escherichia coli assessed as reduction in ATF2 phosphorylation measured after 60 mins by ELI...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50234884
PNG
(CHEMBL4082212)
Show SMILES CSc1nc(c([nH]1)-c1ccnc(Nc2ccc(NC(=O)c3ccc(NC(=O)C=C)cc3)cc2)c1)-c1ccc(F)cc1
Show InChI InChI=1S/C31H25FN6O2S/c1-3-27(39)35-24-10-6-20(7-11-24)30(40)36-25-14-12-23(13-15-25)34-26-18-21(16-17-33-26)29-28(37-31(38-29)41-2)19-4-8-22(32)9-5-19/h3-18H,1H2,2H3,(H,33,34)(H,35,39)(H,36,40)(H,37,38)
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n/an/a 3n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of GST-His tagged human p38alpha expressed in Escherichia coli assessed as reduction in ATF2 phosphorylation measured after 60 mins by ELI...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234879
PNG
(CHEMBL4094220)
Show SMILES CSc1nc(c(-c2ccnc(Nc3cccc(NC(=O)c4cccc(NC(=O)C=C)c4)c3)c2)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C32H27FN6O2S/c1-4-28(40)36-24-8-5-7-22(17-24)31(41)37-26-10-6-9-25(19-26)35-27-18-21(15-16-34-27)30-29(38-32(42-3)39(30)2)20-11-13-23(33)14-12-20/h4-19H,1H2,2-3H3,(H,34,35)(H,36,40)(H,37,41)
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n/an/a 3n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234884
PNG
(CHEMBL4082212)
Show SMILES CSc1nc(c([nH]1)-c1ccnc(Nc2ccc(NC(=O)c3ccc(NC(=O)C=C)cc3)cc2)c1)-c1ccc(F)cc1
Show InChI InChI=1S/C31H25FN6O2S/c1-3-27(39)35-24-10-6-20(7-11-24)30(40)36-25-14-12-23(13-15-25)34-26-18-21(16-17-33-26)29-28(37-31(38-29)41-2)19-4-8-22(32)9-5-19/h3-18H,1H2,2H3,(H,33,34)(H,35,39)(H,36,40)(H,37,38)
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n/an/a 3n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234895
PNG
(CHEMBL4071770)
Show SMILES CSc1nc(c(-c2ccnc(Nc3cccc(NC(=O)c4cccc(NC(=O)C=C)c4C)c3)c2)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C33H29FN6O2S/c1-5-29(41)38-27-11-7-10-26(20(27)2)32(42)37-25-9-6-8-24(19-25)36-28-18-22(16-17-35-28)31-30(39-33(43-4)40(31)3)21-12-14-23(34)15-13-21/h5-19H,1H2,2-4H3,(H,35,36)(H,37,42)(H,38,41)
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n/an/a 3n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50234883
PNG
(CHEMBL4069805)
Show SMILES CCC(=O)Nc1cccc(c1)C(=O)Nc1ccc(Nc2cc(ccn2)-c2[nH]c(SC)nc2-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C31H27FN6O2S/c1-3-27(39)35-25-6-4-5-21(17-25)30(40)36-24-13-11-23(12-14-24)34-26-18-20(15-16-33-26)29-28(37-31(38-29)41-2)19-7-9-22(32)10-8-19/h4-18H,3H2,1-2H3,(H,33,34)(H,35,39)(H,36,40)(H,37,38)
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n/an/a 4n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of GST-His tagged human p38alpha expressed in Escherichia coli assessed as reduction in ATF2 phosphorylation measured after 60 mins by ELI...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234894
PNG
(CHEMBL4072555)
Show SMILES CSc1nc(c(-c2ccnc(Nc3cccc(NC(=O)c4ccc(NC(=O)C=C)cc4)c3)c2)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C32H27FN6O2S/c1-4-28(40)36-24-14-10-21(11-15-24)31(41)37-26-7-5-6-25(19-26)35-27-18-22(16-17-34-27)30-29(38-32(42-3)39(30)2)20-8-12-23(33)13-9-20/h4-19H,1H2,2-3H3,(H,34,35)(H,36,40)(H,37,41)
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n/an/a 4n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234893
PNG
(CHEMBL4063964)
Show SMILES CSc1nc(c(-c2ccnc(Nc3ccc(NC(=O)c4ccc(NC(=O)C=C)cc4)cc3C)c2)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C33H29FN6O2S/c1-5-29(41)36-25-12-8-22(9-13-25)32(42)37-26-14-15-27(20(2)18-26)38-28-19-23(16-17-35-28)31-30(39-33(43-4)40(31)3)21-6-10-24(34)11-7-21/h5-19H,1H2,2-4H3,(H,35,38)(H,36,41)(H,37,42)
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n/an/a 8n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234877
PNG
(CHEMBL4101953)
Show SMILES CSc1nc(c(-c2ccnc(Nc3ccc(NC(=O)c4ccc(NC(=O)C=C)cc4)cc3)c2)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C32H27FN6O2S/c1-4-28(40)36-25-11-7-21(8-12-25)31(41)37-26-15-13-24(14-16-26)35-27-19-22(17-18-34-27)30-29(38-32(42-3)39(30)2)20-5-9-23(33)10-6-20/h4-19H,1H2,2-3H3,(H,34,35)(H,36,40)(H,37,41)
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n/an/a 10n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50103004
PNG
(CHEMBL3394120)
Show SMILES COC(Cn1c(S\C=C/C(O)=O)nc(c1-c1ccnc(NC2CC2)c1)-c1ccc(F)cc1)OC
Show InChI InChI=1S/C24H25FN4O4S/c1-32-21(33-2)14-29-23(16-9-11-26-19(13-16)27-18-7-8-18)22(15-3-5-17(25)6-4-15)28-24(29)34-12-10-20(30)31/h3-6,9-13,18,21H,7-8,14H2,1-2H3,(H,26,27)(H,30,31)/b12-10-
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n/an/a 12n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of JNK3 (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50103129
PNG
(CHEMBL3394125)
Show SMILES OC(=O)\C=C/Sc1nc(c([nH]1)-c1ccnc(Nc2ccccc2)c1)-c1ccc(F)cc1
Show InChI InChI=1S/C23H17FN4O2S/c24-17-8-6-15(7-9-17)21-22(28-23(27-21)31-13-11-20(29)30)16-10-12-25-19(14-16)26-18-4-2-1-3-5-18/h1-14H,(H,25,26)(H,27,28)(H,29,30)/b13-11-
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n/an/a 17n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of JNK3 (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50234892
PNG
(CHEMBL4085536)
Show SMILES CCC(=O)Nc1ccc(cc1)C(=O)Nc1ccc(Nc2cc(ccn2)-c2c(nc(SC)n2C)-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C32H29FN6O2S/c1-4-28(40)36-25-11-7-21(8-12-25)31(41)37-26-15-13-24(14-16-26)35-27-19-22(17-18-34-27)30-29(38-32(42-3)39(30)2)20-5-9-23(33)10-6-20/h5-19H,4H2,1-3H3,(H,34,35)(H,36,40)(H,37,41)
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n/an/a 17n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of GST-His tagged human p38alpha expressed in Escherichia coli assessed as reduction in ATF2 phosphorylation measured after 60 mins by ELI...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234891
PNG
(CHEMBL4066691)
Show SMILES CCC(=O)Nc1cccc(C(=O)Nc2ccc(Nc3cc(ccn3)-c3c(nc(SC)n3C)-c3ccc(F)cc3)cc2)c1C
Show InChI InChI=1S/C33H31FN6O2S/c1-5-29(41)38-27-8-6-7-26(20(27)2)32(42)37-25-15-13-24(14-16-25)36-28-19-22(17-18-35-28)31-30(39-33(43-4)40(31)3)21-9-11-23(34)12-10-21/h6-19H,5H2,1-4H3,(H,35,36)(H,37,42)(H,38,41)
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n/an/a 17n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50234888
PNG
(CHEMBL4074524)
Show SMILES CSc1nc(c([nH]1)-c1ccnc(Nc2ccc(N)cc2)c1)-c1ccc(F)cc1
Show InChI InChI=1S/C21H18FN5S/c1-28-21-26-19(13-2-4-15(22)5-3-13)20(27-21)14-10-11-24-18(12-14)25-17-8-6-16(23)7-9-17/h2-12H,23H2,1H3,(H,24,25)(H,26,27)
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n/an/a 17n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of GST-His tagged human p38alpha expressed in Escherichia coli assessed as reduction in ATF2 phosphorylation measured after 60 mins by ELI...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50103104
PNG
(CHEMBL3394106)
Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(S\C=C/C(O)=O)n1CC1CC1)-c1ccc(F)cc1
Show InChI InChI=1S/C23H21FN4O3S/c1-14(29)26-19-12-17(8-10-25-19)22-21(16-4-6-18(24)7-5-16)27-23(32-11-9-20(30)31)28(22)13-15-2-3-15/h4-12,15H,2-3,13H2,1H3,(H,30,31)(H,25,26,29)/b11-9-
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n/an/a 18n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of JNK3 (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50234897
PNG
(CHEMBL4093282)
Show SMILES CCC(=O)Nc1ccc(cc1)C(=O)Nc1ccc(Nc2cc(ccn2)-c2c(nc(SC)n2C)-c2ccc(F)cc2)c(C)c1
Show InChI InChI=1S/C33H31FN6O2S/c1-5-29(41)36-25-12-8-22(9-13-25)32(42)37-26-14-15-27(20(2)18-26)38-28-19-23(16-17-35-28)31-30(39-33(43-4)40(31)3)21-6-10-24(34)11-7-21/h6-19H,5H2,1-4H3,(H,35,38)(H,36,41)(H,37,42)
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n/an/a 22n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of GST-His tagged human p38alpha expressed in Escherichia coli assessed as reduction in ATF2 phosphorylation measured after 60 mins by ELI...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234882
PNG
(CHEMBL4092482)
Show SMILES CCC(=O)Nc1cccc(c1)C(=O)Nc1ccc(Nc2cc(ccn2)-c2c(nc(SC)n2C)-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C32H29FN6O2S/c1-4-28(40)36-26-7-5-6-22(18-26)31(41)37-25-14-12-24(13-15-25)35-27-19-21(16-17-34-27)30-29(38-32(42-3)39(30)2)20-8-10-23(33)11-9-20/h5-19H,4H2,1-3H3,(H,34,35)(H,36,40)(H,37,41)
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n/an/a 23n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234888
PNG
(CHEMBL4074524)
Show SMILES CSc1nc(c([nH]1)-c1ccnc(Nc2ccc(N)cc2)c1)-c1ccc(F)cc1
Show InChI InChI=1S/C21H18FN5S/c1-28-21-26-19(13-2-4-15(22)5-3-13)20(27-21)14-10-11-24-18(12-14)25-17-8-6-16(23)7-9-17/h2-12H,23H2,1H3,(H,24,25)(H,26,27)
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n/an/a 24n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234897
PNG
(CHEMBL4093282)
Show SMILES CCC(=O)Nc1ccc(cc1)C(=O)Nc1ccc(Nc2cc(ccn2)-c2c(nc(SC)n2C)-c2ccc(F)cc2)c(C)c1
Show InChI InChI=1S/C33H31FN6O2S/c1-5-29(41)36-25-12-8-22(9-13-25)32(42)37-26-14-15-27(20(2)18-26)38-28-19-23(16-17-35-28)31-30(39-33(43-4)40(31)3)21-6-10-24(34)11-7-21/h6-19H,5H2,1-4H3,(H,35,38)(H,36,41)(H,37,42)
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n/an/a 25n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50102911
PNG
(CHEMBL3394107)
Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(S\C=C/C(O)=O)n1CC1CCCCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C26H27FN4O3S/c1-17(32)29-22-15-20(11-13-28-22)25-24(19-7-9-21(27)10-8-19)30-26(35-14-12-23(33)34)31(25)16-18-5-3-2-4-6-18/h7-15,18H,2-6,16H2,1H3,(H,33,34)(H,28,29,32)/b14-12-
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n/an/a 25n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of JNK3 (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50103006
PNG
(CHEMBL3394121)
Show SMILES CCC(C)Nc1cc(ccn1)-c1c(nc(S\C=C/C(O)=O)n1CC(OC)OC)-c1ccc(F)cc1
Show InChI InChI=1S/C25H29FN4O4S/c1-5-16(2)28-20-14-18(10-12-27-20)24-23(17-6-8-19(26)9-7-17)29-25(35-13-11-21(31)32)30(24)15-22(33-3)34-4/h6-14,16,22H,5,15H2,1-4H3,(H,27,28)(H,31,32)/b13-11-
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n/an/a 26n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of JNK3 (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50234894
PNG
(CHEMBL4072555)
Show SMILES CSc1nc(c(-c2ccnc(Nc3cccc(NC(=O)c4ccc(NC(=O)C=C)cc4)c3)c2)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C32H27FN6O2S/c1-4-28(40)36-24-14-10-21(11-15-24)31(41)37-26-7-5-6-25(19-26)35-27-18-22(16-17-34-27)30-29(38-32(42-3)39(30)2)20-8-12-23(33)13-9-20/h4-19H,1H2,2-3H3,(H,34,35)(H,36,40)(H,37,41)
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n/an/a 26n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of GST-His tagged human p38alpha expressed in Escherichia coli assessed as reduction in ATF2 phosphorylation measured after 60 mins by ELI...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234892
PNG
(CHEMBL4085536)
Show SMILES CCC(=O)Nc1ccc(cc1)C(=O)Nc1ccc(Nc2cc(ccn2)-c2c(nc(SC)n2C)-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C32H29FN6O2S/c1-4-28(40)36-25-11-7-21(8-12-25)31(41)37-26-15-13-24(14-16-26)35-27-19-22(17-18-34-27)30-29(38-32(42-3)39(30)2)20-5-9-23(33)10-6-20/h5-19H,4H2,1-3H3,(H,34,35)(H,36,40)(H,37,41)
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n/an/a 27n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50103104
PNG
(CHEMBL3394106)
Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(S\C=C/C(O)=O)n1CC1CC1)-c1ccc(F)cc1
Show InChI InChI=1S/C23H21FN4O3S/c1-14(29)26-19-12-17(8-10-25-19)22-21(16-4-6-18(24)7-5-16)27-23(32-11-9-20(30)31)28(22)13-15-2-3-15/h4-12,15H,2-3,13H2,1H3,(H,30,31)(H,25,26,29)/b11-9-
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n/an/a 30n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of p38alpha (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50234881
PNG
(CHEMBL4104351)
Show SMILES CSc1nc(c(-c2ccnc(Nc3ccc(NC(=O)c4cccc(N)c4)cc3)c2)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C29H25FN6OS/c1-36-27(26(35-29(36)38-2)18-6-8-21(30)9-7-18)19-14-15-32-25(17-19)33-23-10-12-24(13-11-23)34-28(37)20-4-3-5-22(31)16-20/h3-17H,31H2,1-2H3,(H,32,33)(H,34,37)
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n/an/a 30n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of recombinant 6x-His-tagged JNK3 (39 to 402 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as reduction in A...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50102997
PNG
(CHEMBL3394101)
Show SMILES COC(Cn1c(S\C=C/C(O)=O)nc(c1-c1ccnc(NC(C)=O)c1)-c1ccc(F)cc1)OC
Show InChI InChI=1S/C23H23FN4O5S/c1-14(29)26-18-12-16(8-10-25-18)22-21(15-4-6-17(24)7-5-15)27-23(34-11-9-19(30)31)28(22)13-20(32-2)33-3/h4-12,20H,13H2,1-3H3,(H,30,31)(H,25,26,29)/b11-9-
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n/an/a 33n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of JNK3 (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50103006
PNG
(CHEMBL3394121)
Show SMILES CCC(C)Nc1cc(ccn1)-c1c(nc(S\C=C/C(O)=O)n1CC(OC)OC)-c1ccc(F)cc1
Show InChI InChI=1S/C25H29FN4O4S/c1-5-16(2)28-20-14-18(10-12-27-20)24-23(17-6-8-19(26)9-7-17)29-25(35-13-11-21(31)32)30(24)15-22(33-3)34-4/h6-14,16,22H,5,15H2,1-4H3,(H,27,28)(H,31,32)/b13-11-
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n/an/a 34n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of p38alpha (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50234893
PNG
(CHEMBL4063964)
Show SMILES CSc1nc(c(-c2ccnc(Nc3ccc(NC(=O)c4ccc(NC(=O)C=C)cc4)cc3C)c2)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C33H29FN6O2S/c1-5-29(41)36-25-12-8-22(9-13-25)32(42)37-26-14-15-27(20(2)18-26)38-28-19-23(16-17-35-28)31-30(39-33(43-4)40(31)3)21-6-10-24(34)11-7-21/h5-19H,1H2,2-4H3,(H,35,38)(H,36,41)(H,37,42)
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n/an/a 35n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of GST-His tagged human p38alpha expressed in Escherichia coli assessed as reduction in ATF2 phosphorylation measured after 60 mins by ELI...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50103010
PNG
(CHEMBL3394108)
Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(S\C=C/C(O)=O)n1CC1CCCO1)-c1ccc(F)cc1
Show InChI InChI=1S/C24H23FN4O4S/c1-15(30)27-20-13-17(8-10-26-20)23-22(16-4-6-18(25)7-5-16)28-24(34-12-9-21(31)32)29(23)14-19-3-2-11-33-19/h4-10,12-13,19H,2-3,11,14H2,1H3,(H,31,32)(H,26,27,30)/b12-9-
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n/an/a 35n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of JNK3 (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50103129
PNG
(CHEMBL3394125)
Show SMILES OC(=O)\C=C/Sc1nc(c([nH]1)-c1ccnc(Nc2ccccc2)c1)-c1ccc(F)cc1
Show InChI InChI=1S/C23H17FN4O2S/c24-17-8-6-15(7-9-17)21-22(28-23(27-21)31-13-11-20(29)30)16-10-12-25-19(14-16)26-18-4-2-1-3-5-18/h1-14H,(H,25,26)(H,27,28)(H,29,30)/b13-11-
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n/an/a 36n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of p38alpha (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50102919
PNG
(CHEMBL3394097)
Show SMILES CC(=O)CSc1nc(c(-c2ccnc(NC(C)=O)c2)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C20H19FN4O2S/c1-12(26)11-28-20-24-18(14-4-6-16(21)7-5-14)19(25(20)3)15-8-9-22-17(10-15)23-13(2)27/h4-10H,11H2,1-3H3,(H,22,23,27)
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n/an/a 36n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of p38alpha (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50234890
PNG
(CHEMBL4077018)
Show SMILES CSc1nc(c(-c2ccnc(Nc3ccc(NC(=O)c4cccc(NC(=O)C=C)c4)cc3)c2)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C32H27FN6O2S/c1-4-28(40)36-26-7-5-6-22(18-26)31(41)37-25-14-12-24(13-15-25)35-27-19-21(16-17-34-27)30-29(38-32(42-3)39(30)2)20-8-10-23(33)11-9-20/h4-19H,1H2,2-3H3,(H,34,35)(H,36,40)(H,37,41)
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n/an/a 36n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of GST-His tagged human p38alpha expressed in Escherichia coli assessed as reduction in ATF2 phosphorylation measured after 60 mins by ELI...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50234891
PNG
(CHEMBL4066691)
Show SMILES CCC(=O)Nc1cccc(C(=O)Nc2ccc(Nc3cc(ccn3)-c3c(nc(SC)n3C)-c3ccc(F)cc3)cc2)c1C
Show InChI InChI=1S/C33H31FN6O2S/c1-5-29(41)38-27-8-6-7-26(20(27)2)32(42)37-25-15-13-24(14-16-25)36-28-19-22(17-18-35-28)31-30(39-33(43-4)40(31)3)21-9-11-23(34)12-10-21/h6-19H,5H2,1-4H3,(H,35,36)(H,37,42)(H,38,41)
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n/an/a 38n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of GST-His tagged human p38alpha expressed in Escherichia coli assessed as reduction in ATF2 phosphorylation measured after 60 mins by ELI...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50102911
PNG
(CHEMBL3394107)
Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(S\C=C/C(O)=O)n1CC1CCCCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C26H27FN4O3S/c1-17(32)29-22-15-20(11-13-28-22)25-24(19-7-9-21(27)10-8-19)30-26(35-14-12-23(33)34)31(25)16-18-5-3-2-4-6-18/h7-15,18H,2-6,16H2,1H3,(H,33,34)(H,28,29,32)/b14-12-
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n/an/a 39n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of p38alpha (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50103005
PNG
(CHEMBL3394104)
Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(S\C=C/C(O)=O)n1C1CCCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C24H23FN4O3S/c1-15(30)27-20-14-17(10-12-26-20)23-22(16-6-8-18(25)9-7-16)28-24(33-13-11-21(31)32)29(23)19-4-2-3-5-19/h6-14,19H,2-5H2,1H3,(H,31,32)(H,26,27,30)/b13-11-
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n/an/a 45n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of JNK3 (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50103001
PNG
(CHEMBL3394103)
Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(S\C=C/C(O)=O)n1C1CCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C23H21FN4O3S/c1-14(29)26-19-13-16(9-11-25-19)22-21(15-5-7-17(24)8-6-15)27-23(32-12-10-20(30)31)28(22)18-3-2-4-18/h5-13,18H,2-4H2,1H3,(H,30,31)(H,25,26,29)/b12-10-
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n/an/a 47n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of JNK3 (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50234877
PNG
(CHEMBL4101953)
Show SMILES CSc1nc(c(-c2ccnc(Nc3ccc(NC(=O)c4ccc(NC(=O)C=C)cc4)cc3)c2)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C32H27FN6O2S/c1-4-28(40)36-25-11-7-21(8-12-25)31(41)37-26-15-13-24(14-16-26)35-27-19-22(17-18-34-27)30-29(38-32(42-3)39(30)2)20-5-9-23(33)10-6-20/h4-19H,1H2,2-3H3,(H,34,35)(H,36,40)(H,37,41)
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n/an/a 47n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of GST-His tagged human p38alpha expressed in Escherichia coli assessed as reduction in ATF2 phosphorylation measured after 60 mins by ELI...


J Med Chem 60: 594-607 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01180
BindingDB Entry DOI: 10.7270/Q2891854
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50103103
PNG
(CHEMBL3394123)
Show SMILES OC(=O)\C=C/Sc1nc(c(-c2ccnc(Nc3ccccc3)c2)n1CC1CC1)-c1ccc(F)cc1
Show InChI InChI=1S/C27H23FN4O2S/c28-21-10-8-19(9-11-21)25-26(20-12-14-29-23(16-20)30-22-4-2-1-3-5-22)32(17-18-6-7-18)27(31-25)35-15-13-24(33)34/h1-5,8-16,18H,6-7,17H2,(H,29,30)(H,33,34)/b15-13-
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n/an/a 54n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of JNK3 (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50103002
PNG
(CHEMBL3394100)
Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(S\C=C/C(O)=O)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C20H17FN4O3S/c1-12(26)23-16-11-14(7-9-22-16)19-18(13-3-5-15(21)6-4-13)24-20(25(19)2)29-10-8-17(27)28/h3-11H,1-2H3,(H,27,28)(H,22,23,26)/b10-8-
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n/an/a 55n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of JNK3 (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50103007
PNG
(CHEMBL3394122)
Show SMILES CCNC(=O)N1CCC(CC1)Nc1cc(ccn1)-c1c(nc(S\C=C/C(O)=O)n1C)-c1ccc(F)cc1
Show InChI InChI=1S/C26H29FN6O3S/c1-3-28-25(36)33-13-9-20(10-14-33)30-21-16-18(8-12-29-21)24-23(17-4-6-19(27)7-5-17)31-26(32(24)2)37-15-11-22(34)35/h4-8,11-12,15-16,20H,3,9-10,13-14H2,1-2H3,(H,28,36)(H,29,30)(H,34,35)/b15-11-
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n/an/a 61n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of JNK3 (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50103003
PNG
(CHEMBL3394119)
Show SMILES COC(Cn1c(SCC#N)nc(c1-c1ccnc(NC2CC2)c1)-c1ccc(F)cc1)OC
Show InChI InChI=1S/C23H24FN5O2S/c1-30-20(31-2)14-29-22(16-9-11-26-19(13-16)27-18-7-8-18)21(28-23(29)32-12-10-25)15-3-5-17(24)6-4-15/h3-6,9,11,13,18,20H,7-8,12,14H2,1-2H3,(H,26,27)
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n/an/a 79n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of JNK3 (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50102912
PNG
(CHEMBL3394110)
Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(SC2CCC(CC2O)C(O)=O)n1C1CCCCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C29H33FN4O4S/c1-17(35)32-25-16-19(13-14-31-25)27-26(18-7-10-21(30)11-8-18)33-29(34(27)22-5-3-2-4-6-22)39-24-12-9-20(28(37)38)15-23(24)36/h7-8,10-11,13-14,16,20,22-24,36H,2-6,9,12,15H2,1H3,(H,37,38)(H,31,32,35)
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n/an/a 79n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of JNK3 (unknown origin) assessed as phosphorylation of ATF-2 by ELISA


J Med Chem 58: 443-56 (2015)


Article DOI: 10.1021/jm501557a
BindingDB Entry DOI: 10.7270/Q2RN39MX
More data for this
Ligand-Target Pair
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