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Compile Data Set for Download or QSAR

Found 63 hits with Last Name = 'reeder' and Initial = 'md'   
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 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50042034
PNG
((5Z)-7-Oxozeaenol | 5Z-7-Oxozeaenol | CHEBI:67559 ...)
Show SMILES COc1cc(O)c2c(c1)\C=C\C[C@H](O)[C@H](O)C(=O)\C=C/C[C@H](C)OC2=O |r,c:19,t:10|
Show InChI InChI=1S/C19H22O7/c1-11-5-3-7-14(20)18(23)15(21)8-4-6-12-9-13(25-2)10-16(22)17(12)19(24)26-11/h3-4,6-7,9-11,15,18,21-23H,5,8H2,1-2H3/b6-4+,7-3-/t11-,15-,18+/m0/s1
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n/an/a 8n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191935
PNG
(CHEMBL1761718)
Show SMILES Oc1ccc(cc1)N1C(=O)CS\C1=N/N=C1\C(=O)Nc2ccc(Br)cc12
Show InChI InChI=1S/C17H11BrN4O3S/c18-9-1-6-13-12(7-9)15(16(25)19-13)20-21-17-22(14(24)8-26-17)10-2-4-11(23)5-3-10/h1-7,23H,8H2,(H,19,20,25)/b21-17-
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n/an/a 8.90n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191939
PNG
(CHEMBL1761588)
Show SMILES Oc1ccc(cc1)N1C(=O)CS\C1=N/N=C1\C(=O)Nc2ccc(Cl)cc12
Show InChI InChI=1S/C17H11ClN4O3S/c18-9-1-6-13-12(7-9)15(16(25)19-13)20-21-17-22(14(24)8-26-17)10-2-4-11(23)5-3-10/h1-7,23H,8H2,(H,19,20,25)/b21-17-
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n/an/a 21n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191941
PNG
(CHEMBL1761586)
Show SMILES Cc1ccc2NC(=O)\C(=N/N=C3\SCC(=O)N3c3ccc(O)cc3)c2c1
Show InChI InChI=1S/C18H14N4O3S/c1-10-2-7-14-13(8-10)16(17(25)19-14)20-21-18-22(15(24)9-26-18)11-3-5-12(23)6-4-11/h2-8,23H,9H2,1H3,(H,19,20,25)/b21-18-
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n/an/a 42n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191785
PNG
(CHEMBL1761585)
Show SMILES Oc1ccc(cc1)N1C(=O)CS\C1=N/N=C1\C(=O)Nc2ccccc12
Show InChI InChI=1S/C17H12N4O3S/c22-11-7-5-10(6-8-11)21-14(23)9-25-17(21)20-19-15-12-3-1-2-4-13(12)18-16(15)24/h1-8,22H,9H2,(H,18,19,24)/b20-17-
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n/an/a 46n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191940
PNG
(CHEMBL1761587)
Show SMILES Oc1ccc(cc1)N1C(=O)CS\C1=N/N=C1\C(=O)Nc2ccc(F)cc12
Show InChI InChI=1S/C17H11FN4O3S/c18-9-1-6-13-12(7-9)15(16(25)19-13)20-21-17-22(14(24)8-26-17)10-2-4-11(23)5-3-10/h1-7,23H,8H2,(H,19,20,25)/b21-17-
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n/an/a 99n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314444
PNG
(2-(4-chlorophenyl)-10-thia-5,7,12-triazatetracyclo...)
Show SMILES Nc1ncnc2c1sc1nc3CCCCCCCc3c(-c3ccc(Cl)cc3)c21
Show InChI InChI=1S/C22H21ClN4S/c23-14-10-8-13(9-11-14)17-15-6-4-2-1-3-5-7-16(15)27-22-18(17)19-20(28-22)21(24)26-12-25-19/h8-12H,1-7H2,(H2,24,25,26)
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n/an/a 110n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314436
PNG
(3-amino-4-(furan-2-yl)-6,7,8,9,10,11-hexahydro-5H-...)
Show SMILES NC(=O)c1sc2nc3CCCCCCCc3c(-c3ccco3)c2c1N
Show InChI InChI=1S/C19H21N3O2S/c20-16-15-14(13-9-6-10-24-13)11-7-4-2-1-3-5-8-12(11)22-19(15)25-17(16)18(21)23/h6,9-10H,1-5,7-8,20H2,(H2,21,23)
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n/an/a 170n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314406
PNG
(8-(morpholin-4-yl)-11-thia-9,14,16-triazatetracycl...)
Show SMILES Nc1ncnc2c1sc1nc(N3CCOCC3)c3CCCCc3c21
Show InChI InChI=1S/C17H19N5OS/c18-15-14-13(19-9-20-15)12-10-3-1-2-4-11(10)16(21-17(12)24-14)22-5-7-23-8-6-22/h9H,1-8H2,(H2,18,19,20)
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Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314427
PNG
(3-amino-4-(5-chlorofuran-2-yl)-5,6,7,8,9,10-hexahy...)
Show SMILES NC(=O)c1sc2nc3CCCCCCc3c(-c3ccc(Cl)o3)c2c1N
Show InChI InChI=1S/C18H18ClN3O2S/c19-12-8-7-11(24-12)13-9-5-3-1-2-4-6-10(9)22-18-14(13)15(20)16(25-18)17(21)23/h7-8H,1-6,20H2,(H2,21,23)
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n/an/a 280n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314428
PNG
(3-amino-4-(5-(trifluoromethyl)furan-2-yl)-5,6,7,8,...)
Show SMILES NC(=O)c1sc2nc3CCCCCCc3c(-c3ccc(o3)C(F)(F)F)c2c1N
Show InChI InChI=1S/C19H18F3N3O2S/c20-19(21,22)12-8-7-11(27-12)13-9-5-3-1-2-4-6-10(9)25-18-14(13)15(23)16(28-18)17(24)26/h7-8H,1-6,23H2,(H2,24,26)
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n/an/a 300n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314419
PNG
((E)-3-amino-4-(2-(furan-2-yl)vinyl)-5,6,7,8,9,10-h...)
Show SMILES NC(=O)c1sc2nc3CCCCCCc3c(\C=C\c3ccco3)c2c1N
Show InChI InChI=1S/C20H21N3O2S/c21-17-16-14(10-9-12-6-5-11-25-12)13-7-3-1-2-4-8-15(13)23-20(16)26-18(17)19(22)24/h5-6,9-11H,1-4,7-8,21H2,(H2,22,24)/b10-9+
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n/an/a 320n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314429
PNG
(3-amino-4-(benzofuran-2-yl)-5,6,7,8,9,10-hexahydro...)
Show SMILES NC(=O)c1sc2nc3CCCCCCc3c(-c3cc4ccccc4o3)c2c1N
Show InChI InChI=1S/C22H21N3O2S/c23-19-18-17(16-11-12-7-5-6-10-15(12)27-16)13-8-3-1-2-4-9-14(13)25-22(18)28-20(19)21(24)26/h5-7,10-11H,1-4,8-9,23H2,(H2,24,26)
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n/an/a 330n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314442
PNG
(2-(furan-2-yl)-10-thia-5,7,12-triazatetracyclo[11....)
Show SMILES Nc1ncnc2c1sc1nc3CCCCCCCc3c(-c3ccco3)c21
Show InChI InChI=1S/C20H20N4OS/c21-19-18-17(22-11-23-19)16-15(14-9-6-10-25-14)12-7-4-2-1-3-5-8-13(12)24-20(16)26-18/h6,9-11H,1-5,7-8H2,(H2,21,22,23)
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Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314420
PNG
(3-amino-4-(3-methylthiophen-2-yl)-5,6,7,8,9,10-hex...)
Show SMILES Cc1ccsc1-c1c2CCCCCCc2nc2sc(C(N)=O)c(N)c12 |(19.42,1.74,;17.96,2.21,;17.48,3.68,;15.94,3.68,;15.47,2.21,;16.72,1.31,;16.72,-.23,;15.39,-1,;14.31,.09,;12.76,.09,;11.67,-1,;11.67,-2.54,;12.77,-3.63,;14.31,-3.63,;15.39,-2.54,;16.72,-3.31,;18.05,-2.55,;19.53,-3.03,;20.44,-1.78,;21.98,-1.79,;22.76,-.45,;22.75,-3.12,;19.53,-.52,;20.01,.94,;18.05,-1,)|
Show InChI InChI=1S/C19H21N3OS2/c1-10-8-9-24-16(10)13-11-6-4-2-3-5-7-12(11)22-19-14(13)15(20)17(25-19)18(21)23/h8-9H,2-7,20H2,1H3,(H2,21,23)
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Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191900
PNG
(CHEMBL1761749)
Show SMILES Oc1ccc(cc1O)C(=O)\C=C1/C(=O)Nc2ccccc12
Show InChI InChI=1S/C16H11NO4/c18-13-6-5-9(7-15(13)20)14(19)8-11-10-3-1-2-4-12(10)17-16(11)21/h1-8,18,20H,(H,17,21)/b11-8-
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Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191786
PNG
(CHEMBL1761742)
Show SMILES CC1S\C(=N/N=C2\C(=O)Nc3ccc(Cl)cc23)N(C1=O)c1ccc(O)cc1
Show InChI InChI=1S/C18H13ClN4O3S/c1-9-17(26)23(11-3-5-12(24)6-4-11)18(27-9)22-21-15-13-8-10(19)2-7-14(13)20-16(15)25/h2-9,24H,1H3,(H,20,21,25)/b22-18-
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n/an/a 630n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314418
PNG
(3-amino-4-(furan-2-yl)-5,6,7,8,9,10-hexahydrocyclo...)
Show SMILES NC(=O)c1sc2nc3CCCCCCc3c(-c3ccco3)c2c1N
Show InChI InChI=1S/C18H19N3O2S/c19-15-14-13(12-8-5-9-23-12)10-6-3-1-2-4-7-11(10)21-18(14)24-16(15)17(20)22/h5,8-9H,1-4,6-7,19H2,(H2,20,22)
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Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314430
PNG
(3-amino-4-(5-ethylfuran-2-yl)-5,6,7,8,9,10-hexahyd...)
Show SMILES CCc1ccc(o1)-c1c2CCCCCCc2nc2sc(C(N)=O)c(N)c12
Show InChI InChI=1S/C20H23N3O2S/c1-2-11-9-10-14(25-11)15-12-7-5-3-4-6-8-13(12)23-20-16(15)17(21)18(26-20)19(22)24/h9-10H,2-8,21H2,1H3,(H2,22,24)
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n/an/a 660n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314431
PNG
(3-amino-4-(5-(hydroxymethyl)furan-2-yl)-5,6,7,8,9,...)
Show SMILES NC(=O)c1sc2nc3CCCCCCc3c(-c3ccc(CO)o3)c2c1N
Show InChI InChI=1S/C19H21N3O3S/c20-16-15-14(13-8-7-10(9-23)25-13)11-5-3-1-2-4-6-12(11)22-19(15)26-17(16)18(21)24/h7-8,23H,1-6,9,20H2,(H2,21,24)
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n/an/a 800n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314409
PNG
(3-amino-4-isobutyl-5,6,7,8,9,10-hexahydrocycloocta...)
Show SMILES CC(C)Cc1c2CCCCCCc2nc2sc(C(N)=O)c(N)c12
Show InChI InChI=1S/C18H25N3OS/c1-10(2)9-12-11-7-5-3-4-6-8-13(11)21-18-14(12)15(19)16(23-18)17(20)22/h10H,3-9,19H2,1-2H3,(H2,20,22)
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n/an/a 860n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314415
PNG
(4-(3-amino-2-carbamoyl-5,6,7,8,9,10-hexahydrocyclo...)
Show SMILES NC(=O)c1sc2nc3CCCCCCc3c(-c3ccc(cc3)C(O)=O)c2c1N
Show InChI InChI=1S/C21H21N3O3S/c22-17-16-15(11-7-9-12(10-8-11)21(26)27)13-5-3-1-2-4-6-14(13)24-20(16)28-18(17)19(23)25/h7-10H,1-6,22H2,(H2,23,25)(H,26,27)
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n/an/a 860n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314421
PNG
(3-amino-4-(pyridin-3-yl)-5,6,7,8,9,10-hexahydrocyc...)
Show SMILES NC(=O)c1sc2nc3CCCCCCc3c(-c3cccnc3)c2c1N
Show InChI InChI=1S/C19H20N4OS/c20-16-15-14(11-6-5-9-22-10-11)12-7-3-1-2-4-8-13(12)23-19(15)25-17(16)18(21)24/h5-6,9-10H,1-4,7-8,20H2,(H2,21,24)
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n/an/a 940n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314422
PNG
(3-amino-4-(1-methyl-1H-pyrrol-2-yl)-5,6,7,8,9,10-h...)
Show SMILES Cn1cccc1-c1c2CCCCCCc2nc2sc(C(N)=O)c(N)c12 |(14.66,-10.94,;16.12,-10.46,;16.59,-8.99,;18.13,-8.99,;18.61,-10.46,;17.37,-11.36,;17.38,-12.9,;16.05,-13.67,;14.96,-12.58,;13.42,-12.58,;12.33,-13.67,;12.33,-15.21,;13.42,-16.3,;14.96,-16.3,;16.04,-15.21,;17.37,-15.98,;18.7,-15.22,;20.18,-15.7,;21.1,-14.45,;22.64,-14.46,;23.41,-13.12,;23.4,-15.79,;20.19,-13.19,;20.67,-11.73,;18.71,-13.67,)|
Show InChI InChI=1S/C19H22N4OS/c1-23-10-6-9-13(23)14-11-7-4-2-3-5-8-12(11)22-19-15(14)16(20)17(25-19)18(21)24/h6,9-10H,2-5,7-8,20H2,1H3,(H2,21,24)
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n/an/a 990n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314412
PNG
(3-amino-4-(3,4-dichlorophenyl)-5,6,7,8,9,10-hexahy...)
Show SMILES NC(=O)c1sc2nc3CCCCCCc3c(-c3ccc(Cl)c(Cl)c3)c2c1N
Show InChI InChI=1S/C20H19Cl2N3OS/c21-12-8-7-10(9-13(12)22)15-11-5-3-1-2-4-6-14(11)25-20-16(15)17(23)18(27-20)19(24)26/h7-9H,1-6,23H2,(H2,24,26)
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n/an/a 990n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314423
PNG
(3-amino-4-(furan-3-yl)-5,6,7,8,9,10-hexahydrocyclo...)
Show SMILES NC(=O)c1sc2nc3CCCCCCc3c(-c3ccoc3)c2c1N
Show InChI InChI=1S/C18H19N3O2S/c19-15-14-13(10-7-8-23-9-10)11-5-3-1-2-4-6-12(11)21-18(14)24-16(15)17(20)22/h7-9H,1-6,19H2,(H2,20,22)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314435
PNG
(3-amino-4-(furan-2-yl)-6,7,8,9-tetrahydro-5H-cyclo...)
Show SMILES NC(=O)c1sc2nc3CCCCCc3c(-c3ccco3)c2c1N
Show InChI InChI=1S/C17H17N3O2S/c18-14-13-12(11-7-4-8-22-11)9-5-2-1-3-6-10(9)20-17(13)23-15(14)16(19)21/h4,7-8H,1-3,5-6,18H2,(H2,19,21)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314408
PNG
(3-amino-4-methyl-5,6,7,8,9,10-hexahydrocycloocta[b...)
Show SMILES Cc1c2CCCCCCc2nc2sc(C(N)=O)c(N)c12
Show InChI InChI=1S/C15H19N3OS/c1-8-9-6-4-2-3-5-7-10(9)18-15-11(8)12(16)13(20-15)14(17)19/h2-7,16H2,1H3,(H2,17,19)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314432
PNG
(3-amino-4-(4,5-dimethylfuran-2-yl)-5,6,7,8,9,10-he...)
Show SMILES Cc1cc(oc1C)-c1c2CCCCCCc2nc2sc(C(N)=O)c(N)c12
Show InChI InChI=1S/C20H23N3O2S/c1-10-9-14(25-11(10)2)15-12-7-5-3-4-6-8-13(12)23-20-16(15)17(21)18(26-20)19(22)24/h9H,3-8,21H2,1-2H3,(H2,22,24)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314413
PNG
(3-amino-4-(4-chlorophenyl)-5,6,7,8,9,10-hexahydroc...)
Show SMILES NC(=O)c1sc2nc3CCCCCCc3c(-c3ccc(Cl)cc3)c2c1N
Show InChI InChI=1S/C20H20ClN3OS/c21-12-9-7-11(8-10-12)15-13-5-3-1-2-4-6-14(13)24-20-16(15)17(22)18(26-20)19(23)25/h7-10H,1-6,22H2,(H2,23,25)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314417
PNG
(3-amino-4-m-tolyl-5,6,7,8,9,10-hexahydrocycloocta[...)
Show SMILES Cc1cccc(c1)-c1c2CCCCCCc2nc2sc(C(N)=O)c(N)c12
Show InChI InChI=1S/C21H23N3OS/c1-12-7-6-8-13(11-12)16-14-9-4-2-3-5-10-15(14)24-21-17(16)18(22)19(26-21)20(23)25/h6-8,11H,2-5,9-10,22H2,1H3,(H2,23,25)
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n/an/a 1.20E+3n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314416
PNG
(3-amino-4-(2-fluoro-5-methoxyphenyl)-5,6,7,8,9,10-...)
Show SMILES COc1ccc(F)c(c1)-c1c2CCCCCCc2nc2sc(C(N)=O)c(N)c12 |(1.14,-33.78,;1.14,-35.32,;-.19,-36.08,;-1.53,-35.31,;-2.87,-36.09,;-2.86,-37.63,;-4.19,-38.41,;-1.53,-38.39,;-.19,-37.62,;-1.52,-39.93,;-2.85,-40.69,;-3.94,-39.6,;-5.48,-39.6,;-6.57,-40.69,;-6.57,-42.24,;-5.48,-43.32,;-3.94,-43.32,;-2.86,-42.24,;-1.53,-43.01,;-.2,-42.25,;1.28,-42.73,;2.2,-41.48,;3.74,-41.48,;4.51,-40.15,;4.5,-42.82,;1.29,-40.22,;1.77,-38.76,;-.19,-40.69,)|
Show InChI InChI=1S/C21H22FN3O2S/c1-27-11-8-9-14(22)13(10-11)16-12-6-4-2-3-5-7-15(12)25-21-17(16)18(23)19(28-21)20(24)26/h8-10H,2-7,23H2,1H3,(H2,24,26)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314424
PNG
(3-amino-4-(thiazol-2-yl)-5,6,7,8,9,10-hexahydrocyc...)
Show SMILES NC(=O)c1sc2nc3CCCCCCc3c(-c3nccs3)c2c1N
Show InChI InChI=1S/C17H18N4OS2/c18-13-12-11(16-20-7-8-23-16)9-5-3-1-2-4-6-10(9)21-17(12)24-14(13)15(19)22/h7-8H,1-6,18H2,(H2,19,22)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191828
PNG
(CHEMBL1761747)
Show SMILES Oc1ccc(\C=C2\C(=O)Nc3ccccc23)c(O)c1O
Show InChI InChI=1S/C15H11NO4/c17-12-6-5-8(13(18)14(12)19)7-10-9-3-1-2-4-11(9)16-15(10)20/h1-7,17-19H,(H,16,20)/b10-7+
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n/an/a 1.70E+3n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314410
PNG
(3-amino-4-cyclopropyl-5,6,7,8,9,10-hexahydrocycloo...)
Show SMILES NC(=O)c1sc2nc3CCCCCCc3c(C3CC3)c2c1N
Show InChI InChI=1S/C17H21N3OS/c18-14-13-12(9-7-8-9)10-5-3-1-2-4-6-11(10)20-17(13)22-15(14)16(19)21/h9H,1-8,18H2,(H2,19,21)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314407
PNG
(3-amino-5,6,7,8,9,10-hexahydrocycloocta[b]thieno[3...)
Show SMILES NC(=O)c1sc2nc3CCCCCCc3cc2c1N
Show InChI InChI=1S/C14H17N3OS/c15-11-9-7-8-5-3-1-2-4-6-10(8)17-14(9)19-12(11)13(16)18/h7H,1-6,15H2,(H2,16,18)
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n/an/a 2.50E+3n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191937
PNG
(CHEMBL1761719)
Show SMILES Oc1ccc(cc1)N1C(=O)CS\C1=N/N=C1\C(=O)Nc2ccc(OC(F)(F)F)cc12
Show InChI InChI=1S/C18H11F3N4O4S/c19-18(20,21)29-11-5-6-13-12(7-11)15(16(28)22-13)23-24-17-25(14(27)8-30-17)9-1-3-10(26)4-2-9/h1-7,26H,8H2,(H,22,23,28)/b24-17-
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n/an/a 3.00E+3n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314441
PNG
(10-thia-5,7,12-triazatetracyclo[11.7.0.0^{3,11}.0^...)
Show SMILES Nc1ncnc2c3cc4CCCCCCCc4nc3sc12
Show InChI InChI=1S/C16H18N4S/c17-15-14-13(18-9-19-15)11-8-10-6-4-2-1-3-5-7-12(10)20-16(11)21-14/h8-9H,1-7H2,(H2,17,18,19)
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n/an/a 3.70E+3n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191933
PNG
(CHEMBL1761750)
Show SMILES Oc1cccc(c1)C(=O)\C=C1/C(=O)Nc2ccccc12
Show InChI InChI=1S/C16H11NO3/c18-11-5-3-4-10(8-11)15(19)9-13-12-6-1-2-7-14(12)17-16(13)20/h1-9,18H,(H,17,20)/b13-9-
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n/an/a 4.10E+3n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314445
PNG
(5-Furan-2-yl-7,8,9,10-tetrahydro-6H-12-thia-2,4,11...)
Show SMILES Nc1ncnc2c1sc1nc3CCCCCc3c(-c3ccco3)c21
Show InChI InChI=1S/C18H16N4OS/c19-17-16-15(20-9-21-17)14-13(12-7-4-8-23-12)10-5-2-1-3-6-11(10)22-18(14)24-16/h4,7-9H,1-3,5-6H2,(H2,19,20,21)
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n/an/a 4.70E+3n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191936
PNG
(CHEMBL1761729)
Show SMILES COc1ccc(cc1)N1C(=O)CS\C1=N/N=C1\C(=O)Nc2ccccc12
Show InChI InChI=1S/C18H14N4O3S/c1-25-12-8-6-11(7-9-12)22-15(23)10-26-18(22)21-20-16-13-4-2-3-5-14(13)19-17(16)24/h2-9H,10H2,1H3,(H,19,20,24)/b21-18-
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n/an/a>5.00E+3n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191787
PNG
(CHEMBL1761743)
Show SMILES CCC1S\C(=N/N=C2\C(=O)Nc3ccc(Cl)cc23)N(C1=O)c1ccc(O)cc1
Show InChI InChI=1S/C19H15ClN4O3S/c1-2-15-18(27)24(11-4-6-12(25)7-5-11)19(28-15)23-22-16-13-9-10(20)3-8-14(13)21-17(16)26/h3-9,15,25H,2H2,1H3,(H,21,22,26)/b23-19-
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n/an/a>5.00E+3n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191942
PNG
(CHEMBL1761744)
Show SMILES CC(C)C1S\C(=N/N=C2\C(=O)Nc3ccc(Cl)cc23)N(C1=O)c1ccc(O)cc1
Show InChI InChI=1S/C20H17ClN4O3S/c1-10(2)17-19(28)25(12-4-6-13(26)7-5-12)20(29-17)24-23-16-14-9-11(21)3-8-15(14)22-18(16)27/h3-10,17,26H,1-2H3,(H,22,23,27)/b24-20-
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n/an/a>5.00E+3n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191789
PNG
(CHEMBL1761746)
Show SMILES Oc1ccc(\C=C2\C(=O)Nc3ccccc23)cc1O
Show InChI InChI=1S/C15H11NO3/c17-13-6-5-9(8-14(13)18)7-11-10-3-1-2-4-12(10)16-15(11)19/h1-8,17-18H,(H,16,19)/b11-7+
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n/an/a>5.00E+3n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191938
PNG
(CHEMBL1761730)
Show SMILES O=C1CS\C(N1)=N/N=C1\C(=O)Nc2ccccc12
Show InChI InChI=1S/C11H8N4O2S/c16-8-5-18-11(13-8)15-14-9-6-3-1-2-4-7(6)12-10(9)17/h1-4H,5H2,(H,12,14,17)(H,13,15,16)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50154592
PNG
(3-(2-Oxo-2-phenyl-ethylidene)-1,3-dihydro-indol-2-...)
Show SMILES O=C(\C=C1/C(=O)Nc2ccccc12)c1ccccc1
Show InChI InChI=1S/C16H11NO2/c18-15(11-6-2-1-3-7-11)10-13-12-8-4-5-9-14(12)17-16(13)19/h1-10H,(H,17,19)/b13-10-
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n/an/a>5.00E+3n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191903
PNG
(CHEMBL1761739)
Show SMILES Oc1ccccc1N1C(=O)CS\C1=N/N=C1\C(=O)Nc2ccccc12
Show InChI InChI=1S/C17H12N4O3S/c22-13-8-4-3-7-12(13)21-14(23)9-25-17(21)20-19-15-10-5-1-2-6-11(10)18-16(15)24/h1-8,22H,9H2,(H,18,19,24)/b20-17-
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n/an/a 5.80E+3n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))
BDBM50191829
PNG
(CHEMBL1761737)
Show SMILES O=C1CS\C(=N/N=C2\C(=O)Nc3ccccc23)N1Cc1ccncc1
Show InChI InChI=1S/C17H13N5O2S/c23-14-10-25-17(22(14)9-11-5-7-18-8-6-11)21-20-15-12-3-1-2-4-13(12)19-16(15)24/h1-8H,9-10H2,(H,19,20,24)/b21-17-
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n/an/a 8.20E+3n/an/an/an/an/an/a



Myrexis, Inc.

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


Bioorg Med Chem Lett 21: 1724-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.077
BindingDB Entry DOI: 10.7270/Q2988794
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314440
PNG
(3-amino-6-(cyclohexylmethyl)-4-(furan-2-yl)thieno[...)
Show SMILES NC(=O)c1sc2nc(CC3CCCCC3)cc(-c3ccco3)c2c1N
Show InChI InChI=1S/C19H21N3O2S/c20-16-15-13(14-7-4-8-24-14)10-12(9-11-5-2-1-3-6-11)22-19(15)25-17(16)18(21)23/h4,7-8,10-11H,1-3,5-6,9,20H2,(H2,21,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314439
PNG
(3-amino-6-(2,4-dimethoxybenzyl)-4-(furan-2-yl)thie...)
Show SMILES COc1ccc(Cc2cc(-c3ccco3)c3c(N)c(sc3n2)C(N)=O)c(OC)c1
Show InChI InChI=1S/C21H19N3O4S/c1-26-13-6-5-11(16(10-13)27-2)8-12-9-14(15-4-3-7-28-15)17-18(22)19(20(23)25)29-21(17)24-12/h3-7,9-10H,8,22H2,1-2H3,(H2,23,25)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Myriad Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair
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