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PubMed code 18755587

Compile data set for download or QSAR
Found 46 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50264866
PNG
(4'-(2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridin-4-ylo...)
Show SMILES NC(=O)c1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H14N6O2S/c22-20(28)14-3-1-12(2-4-14)13-5-7-15(8-6-13)29-17-10-23-11-19-16(17)9-18(30-19)21-24-26-27-25-21/h1-11H,(H2,22,28)(H,24,25,26,27)
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n/an/a 10n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50264865
PNG
((4'-(2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridin-4-yl...)
Show SMILES OCc1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H15N5O2S/c27-12-13-1-3-14(4-2-13)15-5-7-16(8-6-15)28-18-10-22-11-20-17(18)9-19(29-20)21-23-25-26-24-21/h1-11,27H,12H2,(H,23,24,25,26)
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n/an/a 40n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50264773
PNG
(4'-(2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridin-4-ylo...)
Show SMILES CN(C)C(=O)c1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C23H18N6O2S/c1-29(2)23(30)16-5-3-14(4-6-16)15-7-9-17(10-8-15)31-19-12-24-13-21-18(19)11-20(32-21)22-25-27-28-26-22/h3-13H,1-2H3,(H,25,26,27,28)
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n/an/a 50n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265350
PNG
(4-(4'-chlorobiphenyl-4-yloxy)-2-(2H-tetrazol-5-yl)...)
Show SMILES Clc1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C20H12ClN5OS/c21-14-5-1-12(2-6-14)13-3-7-15(8-4-13)27-17-10-22-11-19-16(17)9-18(28-19)20-23-25-26-24-20/h1-11H,(H,23,24,25,26)
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n/an/a 90n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50264739
PNG
(4-(3'-chlorobiphenyl-4-yloxy)-2-(2H-tetrazol-5-yl)...)
Show SMILES Clc1cccc(c1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C20H12ClN5OS/c21-14-3-1-2-13(8-14)12-4-6-15(7-5-12)27-17-10-22-11-19-16(17)9-18(28-19)20-23-25-26-24-20/h1-11H,(H,23,24,25,26)
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n/an/a 120n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50264866
PNG
(4'-(2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridin-4-ylo...)
Show SMILES NC(=O)c1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H14N6O2S/c22-20(28)14-3-1-12(2-4-14)13-5-7-15(8-6-13)29-17-10-23-11-19-16(17)9-18(30-19)21-24-26-27-25-21/h1-11H,(H2,22,28)(H,24,25,26,27)
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n/an/a 130n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of COT (unknown origin) by cell-based HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265353
PNG
(4-(4'-methoxybiphenyl-4-yloxy)-2-(2H-tetrazol-5-yl...)
Show SMILES COc1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H15N5O2S/c1-27-15-6-2-13(3-7-15)14-4-8-16(9-5-14)28-18-11-22-12-20-17(18)10-19(29-20)21-23-25-26-24-21/h2-12H,1H3,(H,23,24,25,26)
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n/an/a 130n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50264738
PNG
(4-(2'-chlorobiphenyl-4-yloxy)-2-(2H-tetrazol-5-yl)...)
Show SMILES Clc1ccccc1-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C20H12ClN5OS/c21-16-4-2-1-3-14(16)12-5-7-13(8-6-12)27-17-10-22-11-19-15(17)9-18(28-19)20-23-25-26-24-20/h1-11H,(H,23,24,25,26)
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM28042
PNG
(5-[4-(4-phenylphenoxy)thieno[2,3-c]pyridin-2-yl]-1...)
Show SMILES O(c1ccc(cc1)-c1ccccc1)c1cncc2sc(cc12)-c1nnn[nH]1
Show InChI InChI=1S/C20H13N5OS/c1-2-4-13(5-3-1)14-6-8-15(9-7-14)26-17-11-21-12-19-16(17)10-18(27-19)20-22-24-25-23-20/h1-12H,(H,22,23,24,25)
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50264740
PNG
(4-(4'-fluorobiphenyl-4-yloxy)-2-(2H-tetrazol-5-yl)...)
Show SMILES Fc1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C20H12FN5OS/c21-14-5-1-12(2-6-14)13-3-7-15(8-4-13)27-17-10-22-11-19-16(17)9-18(28-19)20-23-25-26-24-20/h1-11H,(H,23,24,25,26)
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50264741
PNG
(4'-(2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridin-4-ylo...)
Show SMILES Nc1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C20H14N6OS/c21-14-5-1-12(2-6-14)13-3-7-15(8-4-13)27-17-10-22-11-19-16(17)9-18(28-19)20-23-25-26-24-20/h1-11H,21H2,(H,23,24,25,26)
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265352
PNG
(4-(3'-methoxybiphenyl-4-yloxy)-2-(2H-tetrazol-5-yl...)
Show SMILES COc1cccc(c1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H15N5O2S/c1-27-16-4-2-3-14(9-16)13-5-7-15(8-6-13)28-18-11-22-12-20-17(18)10-19(29-20)21-23-25-26-24-21/h2-12H,1H3,(H,23,24,25,26)
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50264742
PNG
(2-(2H-tetrazol-5-yl)-4-(4'-(trifluoromethyl)biphen...)
Show SMILES FC(F)(F)c1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H12F3N5OS/c22-21(23,24)14-5-1-12(2-6-14)13-3-7-15(8-4-13)30-17-10-25-11-19-16(17)9-18(31-19)20-26-28-29-27-20/h1-11H,(H,26,27,28,29)
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265351
PNG
(4'-(2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridin-4-ylo...)
Show SMILES N#Cc1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H12N6OS/c22-10-13-1-3-14(4-2-13)15-5-7-16(8-6-15)28-18-11-23-12-20-17(18)9-19(29-20)21-24-26-27-25-21/h1-9,11-12H,(H,24,25,26,27)
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265349
PNG
(4-(2'-methoxybiphenyl-4-yloxy)-2-(2H-tetrazol-5-yl...)
Show SMILES COc1ccccc1-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H15N5O2S/c1-27-17-5-3-2-4-15(17)13-6-8-14(9-7-13)28-18-11-22-12-20-16(18)10-19(29-20)21-23-25-26-24-21/h2-12H,1H3,(H,23,24,25,26)
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265275
PNG
(4-(4-iodophenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c...)
Show SMILES Ic1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C14H8IN5OS/c15-8-1-3-9(4-2-8)21-11-6-16-7-13-10(11)5-12(22-13)14-17-19-20-18-14/h1-7H,(H,17,18,19,20)
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265276
PNG
(CHEMBL498592 | N-hydroxy-4-(4-iodophenoxy)thieno[2...)
Show SMILES ONC(=O)c1cc2c(Oc3ccc(I)cc3)cncc2s1
Show InChI InChI=1S/C14H9IN2O3S/c15-8-1-3-9(4-2-8)20-11-6-16-7-13-10(11)5-12(21-13)14(18)17-19/h1-7,19H,(H,17,18)
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50264742
PNG
(2-(2H-tetrazol-5-yl)-4-(4'-(trifluoromethyl)biphen...)
Show SMILES FC(F)(F)c1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H12F3N5OS/c22-21(23,24)14-5-1-12(2-6-14)13-3-7-15(8-4-13)30-17-10-25-11-19-16(17)9-18(31-19)20-26-28-29-27-20/h1-11H,(H,26,27,28,29)
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n/an/a 560n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of COT (unknown origin) by cell-based HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265312
PNG
(4-(4-tert-butylphenoxy)-2-(2H-tetrazol-5-yl)thieno...)
Show SMILES CC(C)(C)c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C18H17N5OS/c1-18(2,3)11-4-6-12(7-5-11)24-14-9-19-10-16-13(14)8-15(25-16)17-20-22-23-21-17/h4-10H,1-3H3,(H,20,21,22,23)
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265311
PNG
(4-(4-chlorophenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3...)
Show SMILES Clc1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C14H8ClN5OS/c15-8-1-3-9(4-2-8)21-11-6-16-7-13-10(11)5-12(22-13)14-17-19-20-18-14/h1-7H,(H,17,18,19,20)
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n/an/a 710n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM28045
PNG
(4-(4-iodophenoxy)thieno[2,3-c]pyridine-2-carboxyli...)
Show SMILES OC(=O)c1cc2c(Oc3ccc(I)cc3)cncc2s1
Show InChI InChI=1S/C14H8INO3S/c15-8-1-3-9(4-2-8)19-11-6-16-7-13-10(11)5-12(20-13)14(17)18/h1-7H,(H,17,18)
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n/an/a 940n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265242
PNG
(3-(4-(4-iodophenoxy)thieno[2,3-c]pyridin-2-yl)-1,2...)
Show SMILES Ic1ccc(Oc2cncc3sc(cc23)-c2nc(=O)o[nH]2)cc1
Show InChI InChI=1S/C15H8IN3O3S/c16-8-1-3-9(4-2-8)21-11-6-17-7-13-10(11)5-12(23-13)14-18-15(20)22-19-14/h1-7H,(H,18,19,20)
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n/an/a 1.12E+3n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50264738
PNG
(4-(2'-chlorobiphenyl-4-yloxy)-2-(2H-tetrazol-5-yl)...)
Show SMILES Clc1ccccc1-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C20H12ClN5OS/c21-16-4-2-1-3-14(16)12-5-7-13(8-6-12)27-17-10-22-11-19-15(17)9-18(28-19)20-23-25-26-24-20/h1-11H,(H,23,24,25,26)
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n/an/a 1.50E+3n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of MEK1 (unknown origin) by HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50264741
PNG
(4'-(2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridin-4-ylo...)
Show SMILES Nc1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C20H14N6OS/c21-14-5-1-12(2-6-14)13-3-7-15(8-4-13)27-17-10-22-11-19-16(17)9-18(28-19)20-23-25-26-24-20/h1-11H,21H2,(H,23,24,25,26)
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n/an/a 1.50E+3n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of MEK1 (unknown origin) by HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265310
PNG
(4-(4-bromophenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-...)
Show SMILES Brc1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C14H8BrN5OS/c15-8-1-3-9(4-2-8)21-11-6-16-7-13-10(11)5-12(22-13)14-17-19-20-18-14/h1-7H,(H,17,18,19,20)
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n/an/a 1.60E+3n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265279
PNG
(4-(biphenyl-3-yloxy)-2-(2H-tetrazol-5-yl)thieno[2,...)
Show SMILES O(c1cccc(c1)-c1ccccc1)c1cncc2sc(cc12)-c1nnn[nH]1
Show InChI InChI=1S/C20H13N5OS/c1-2-5-13(6-3-1)14-7-4-8-15(9-14)26-17-11-21-12-19-16(17)10-18(27-19)20-22-24-25-23-20/h1-12H,(H,22,23,24,25)
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n/an/a 1.70E+3n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50264742
PNG
(2-(2H-tetrazol-5-yl)-4-(4'-(trifluoromethyl)biphen...)
Show SMILES FC(F)(F)c1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H12F3N5OS/c22-21(23,24)14-5-1-12(2-6-14)13-3-7-15(8-4-13)30-17-10-25-11-19-16(17)9-18(31-19)20-26-28-29-27-20/h1-11H,(H,26,27,28,29)
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n/an/a 1.80E+3n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of MEK1 (unknown origin) by HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50264739
PNG
(4-(3'-chlorobiphenyl-4-yloxy)-2-(2H-tetrazol-5-yl)...)
Show SMILES Clc1cccc(c1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C20H12ClN5OS/c21-14-3-1-2-13(8-14)12-4-6-15(7-5-12)27-17-10-22-11-19-16(17)9-18(28-19)20-23-25-26-24-20/h1-11H,(H,23,24,25,26)
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n/an/a 1.90E+3n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of MEK1 (unknown origin) by HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265350
PNG
(4-(4'-chlorobiphenyl-4-yloxy)-2-(2H-tetrazol-5-yl)...)
Show SMILES Clc1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C20H12ClN5OS/c21-14-5-1-12(2-6-14)13-3-7-15(8-4-13)27-17-10-22-11-19-16(17)9-18(28-19)20-23-25-26-24-20/h1-11H,(H,23,24,25,26)
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n/an/a 2.10E+3n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of COT (unknown origin) by cell-based HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265277
PNG
(4-phenoxy-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridin...)
Show SMILES O(c1ccccc1)c1cncc2sc(cc12)-c1nnn[nH]1
Show InChI InChI=1S/C14H9N5OS/c1-2-4-9(5-3-1)20-11-7-15-8-13-10(11)6-12(21-13)14-16-18-19-17-14/h1-8H,(H,16,17,18,19)
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n/an/a 2.20E+3n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50265350
PNG
(4-(4'-chlorobiphenyl-4-yloxy)-2-(2H-tetrazol-5-yl)...)
Show SMILES Clc1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C20H12ClN5OS/c21-14-5-1-12(2-6-14)13-3-7-15(8-4-13)27-17-10-22-11-19-16(17)9-18(28-19)20-23-25-26-24-20/h1-11H,(H,23,24,25,26)
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n/an/a 2.40E+3n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of MEK1 (unknown origin) by HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM28042
PNG
(5-[4-(4-phenylphenoxy)thieno[2,3-c]pyridin-2-yl]-1...)
Show SMILES O(c1ccc(cc1)-c1ccccc1)c1cncc2sc(cc12)-c1nnn[nH]1
Show InChI InChI=1S/C20H13N5OS/c1-2-4-13(5-3-1)14-6-8-15(9-7-14)26-17-11-21-12-19-16(17)10-18(27-19)20-22-24-25-23-20/h1-12H,(H,22,23,24,25)
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n/an/a 4.30E+3n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of COT (unknown origin) by cell-based HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50264740
PNG
(4-(4'-fluorobiphenyl-4-yloxy)-2-(2H-tetrazol-5-yl)...)
Show SMILES Fc1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C20H12FN5OS/c21-14-5-1-12(2-6-14)13-3-7-15(8-4-13)27-17-10-22-11-19-16(17)9-18(28-19)20-23-25-26-24-20/h1-11H,(H,23,24,25,26)
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n/an/a 6.50E+3n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of COT (unknown origin) by cell-based HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265309
PNG
(2-(2H-tetrazol-5-yl)-4-(p-tolyloxy)thieno[2,3-c]py...)
Show SMILES Cc1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C15H11N5OS/c1-9-2-4-10(5-3-9)21-12-7-16-8-14-11(12)6-13(22-14)15-17-19-20-18-15/h2-8H,1H3,(H,17,18,19,20)
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n/an/a 7.50E+3n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50264740
PNG
(4-(4'-fluorobiphenyl-4-yloxy)-2-(2H-tetrazol-5-yl)...)
Show SMILES Fc1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C20H12FN5OS/c21-14-5-1-12(2-6-14)13-3-7-15(8-4-13)27-17-10-22-11-19-16(17)9-18(28-19)20-23-25-26-24-20/h1-11H,(H,23,24,25,26)
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n/an/a 7.60E+3n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of MEK1 (unknown origin) by HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM28042
PNG
(5-[4-(4-phenylphenoxy)thieno[2,3-c]pyridin-2-yl]-1...)
Show SMILES O(c1ccc(cc1)-c1ccccc1)c1cncc2sc(cc12)-c1nnn[nH]1
Show InChI InChI=1S/C20H13N5OS/c1-2-4-13(5-3-1)14-6-8-15(9-7-14)26-17-11-21-12-19-16(17)10-18(27-19)20-22-24-25-23-20/h1-12H,(H,22,23,24,25)
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n/an/a 9.70E+3n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of MEK1 (unknown origin) by HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50264865
PNG
((4'-(2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridin-4-yl...)
Show SMILES OCc1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H15N5O2S/c27-12-13-1-3-14(4-2-13)15-5-7-16(8-6-15)28-18-10-22-11-20-17(18)9-19(29-20)21-23-25-26-24-21/h1-11,27H,12H2,(H,23,24,25,26)
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n/an/a 1.40E+4n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of MEK1 (unknown origin) by HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265278
PNG
(4-(biphenyl-2-yloxy)-2-(2H-tetrazol-5-yl)thieno[2,...)
Show SMILES O(c1ccccc1-c1ccccc1)c1cncc2sc(cc12)-c1nnn[nH]1
Show InChI InChI=1S/C20H13N5OS/c1-2-6-13(7-3-1)14-8-4-5-9-16(14)26-17-11-21-12-19-15(17)10-18(27-19)20-22-24-25-23-20/h1-12H,(H,22,23,24,25)
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n/an/a 1.50E+4n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50264866
PNG
(4'-(2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridin-4-ylo...)
Show SMILES NC(=O)c1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H14N6O2S/c22-20(28)14-3-1-12(2-4-14)13-5-7-15(8-6-13)29-17-10-23-11-19-16(17)9-18(30-19)21-24-26-27-25-21/h1-11H,(H2,22,28)(H,24,25,26,27)
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UniChem
Article
PubMed
n/an/a 1.80E+4n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of MEK1 (unknown origin) by HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50265351
PNG
(4'-(2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridin-4-ylo...)
Show SMILES N#Cc1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H12N6OS/c22-10-13-1-3-14(4-2-13)15-5-7-16(8-6-15)28-18-11-23-12-20-17(18)9-19(29-20)21-24-26-27-25-21/h1-9,11-12H,(H,24,25,26,27)
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n/an/a 2.12E+4n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of MEK1 (unknown origin) by HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50265349
PNG
(4-(2'-methoxybiphenyl-4-yloxy)-2-(2H-tetrazol-5-yl...)
Show SMILES COc1ccccc1-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H15N5O2S/c1-27-17-5-3-2-4-15(17)13-6-8-14(9-7-13)28-18-11-22-12-20-16(18)10-19(29-20)21-23-25-26-24-21/h2-12H,1H3,(H,23,24,25,26)
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n/an/a 2.18E+4n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of MEK1 (unknown origin) by HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50265352
PNG
(4-(3'-methoxybiphenyl-4-yloxy)-2-(2H-tetrazol-5-yl...)
Show SMILES COc1cccc(c1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H15N5O2S/c1-27-16-4-2-3-14(9-16)13-5-7-15(8-6-13)28-18-11-22-12-20-17(18)10-19(29-20)21-23-25-26-24-21/h2-12H,1H3,(H,23,24,25,26)
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n/an/a 2.30E+4n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of MEK1 (unknown origin) by HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50264773
PNG
(4'-(2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridin-4-ylo...)
Show SMILES CN(C)C(=O)c1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C23H18N6O2S/c1-29(2)23(30)16-5-3-14(4-6-16)15-7-9-17(10-8-15)31-19-12-24-13-21-18(19)11-20(32-21)22-25-27-28-26-22/h3-13H,1-2H3,(H,25,26,27,28)
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n/an/a 4.80E+4n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of MEK1 (unknown origin) by HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50265353
PNG
(4-(4'-methoxybiphenyl-4-yloxy)-2-(2H-tetrazol-5-yl...)
Show SMILES COc1ccc(cc1)-c1ccc(Oc2cncc3sc(cc23)-c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H15N5O2S/c1-27-15-6-2-13(3-7-15)14-4-8-16(9-5-14)28-18-11-22-12-20-17(18)10-19(29-20)21-23-25-26-24-21/h2-12H,1H3,(H,23,24,25,26)
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n/an/a 4.90E+4n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of MEK1 (unknown origin) by HTRF assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265240
PNG
(4-(4-iodophenoxy)thieno[2,3-c]pyridin-2-amine | CH...)
Show SMILES Nc1cc2c(Oc3ccc(I)cc3)cncc2s1
Show InChI InChI=1S/C13H9IN2OS/c14-8-1-3-9(4-2-8)17-11-6-16-7-12-10(11)5-13(15)18-12/h1-7H,15H2
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n/an/a>5.00E+4n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50265241
PNG
(CHEMBL496947 | N-(4-(4-iodophenoxy)thieno[2,3-c]py...)
Show SMILES CC(=O)Nc1cc2c(Oc3ccc(I)cc3)cncc2s1
Show InChI InChI=1S/C15H11IN2O2S/c1-9(19)18-15-6-12-13(7-17-8-14(12)21-15)20-11-4-2-10(16)3-5-11/h2-8H,1H3,(H,18,19)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COT by HTRF-based assay


Bioorg Med Chem Lett 18: 4952-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.037
BindingDB Entry DOI: 10.7270/Q23J3CTH
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%