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PubMed code 26852363

Compile data set for download or QSAR
Found 72 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
Cyclin-C


(Homo sapiens (Human))		BDBM50154942
PNG
(CHEMBL3775076)
Show SMILES Cn1ncc2cc(Cc3n[nH]c4ccc(cc34)C(=O)N3CCC(F)(F)C3)ccc12
Show InChI InChI=1S/C21H19F2N5O/c1-27-19-5-2-13(8-15(19)11-24-27)9-18-16-10-14(3-4-17(16)25-26-18)20(29)28-7-6-21(22,23)12-28/h2-5,8,10-11H,6-7,9,12H2,1H3,(H,25,26)
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n/an/a 2n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154956
PNG
(CHEMBL3775317)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CC[C@@H](O)C2)cc1 |r|
Show InChI InChI=1S/C23H23N5O2/c1-27-13-18(12-24-27)16-4-2-15(3-5-16)10-22-20-11-17(6-7-21(20)25-26-22)23(30)28-9-8-19(29)14-28/h2-7,11-13,19,29H,8-10,14H2,1H3,(H,25,26)/t19-/m1/s1
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n/an/a 2n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154955
PNG
(CHEMBL3775321)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CC[C@H](O)C2)cc1 |r|
Show InChI InChI=1S/C23H23N5O2/c1-27-13-18(12-24-27)16-4-2-15(3-5-16)10-22-20-11-17(6-7-21(20)25-26-22)23(30)28-9-8-19(29)14-28/h2-7,11-13,19,29H,8-10,14H2,1H3,(H,25,26)/t19-/m0/s1
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n/an/a 3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154941
PNG
(CHEMBL3775024)
Show SMILES Cn1ncc2cc(Cc3n[nH]c4ccc(cc34)C(=O)N3CC[C@H](O)C3)ccc12 |r|
Show InChI InChI=1S/C21H21N5O2/c1-25-20-5-2-13(8-15(20)11-22-25)9-19-17-10-14(3-4-18(17)23-24-19)21(28)26-7-6-16(27)12-26/h2-5,8,10-11,16,27H,6-7,9,12H2,1H3,(H,23,24)/t16-/m0/s1
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n/an/a 4n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154960
PNG
(CHEMBL3775123)
Show SMILES Cn1ncc2cc(Cc3n[nH]c4ccc(cc34)C(=O)N3CC(O)C3)ccc12
Show InChI InChI=1S/C20H19N5O2/c1-24-19-5-2-12(6-14(19)9-21-24)7-18-16-8-13(3-4-17(16)22-23-18)20(27)25-10-15(26)11-25/h2-6,8-9,15,26H,7,10-11H2,1H3,(H,22,23)
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n/an/a 4n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154965
PNG
(CHEMBL3775423)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CC(O)C2)cc1
Show InChI InChI=1S/C22H21N5O2/c1-26-11-17(10-23-26)15-4-2-14(3-5-15)8-21-19-9-16(6-7-20(19)24-25-21)22(29)27-12-18(28)13-27/h2-7,9-11,18,28H,8,12-13H2,1H3,(H,24,25)
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n/an/a 4n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50155241
PNG
(CHEMBL3774885)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CCOCC2)cc1
Show InChI InChI=1S/C23H23N5O2/c1-27-15-19(14-24-27)17-4-2-16(3-5-17)12-22-20-13-18(6-7-21(20)25-26-22)23(29)28-8-10-30-11-9-28/h2-7,13-15H,8-12H2,1H3,(H,25,26)
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n/an/a 4n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50155239
PNG
(CHEMBL3775935)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CCCC2)cc1
Show InChI InChI=1S/C23H23N5O/c1-27-15-19(14-24-27)17-6-4-16(5-7-17)12-22-20-13-18(8-9-21(20)25-26-22)23(29)28-10-2-3-11-28/h4-9,13-15H,2-3,10-12H2,1H3,(H,25,26)
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n/an/a 4n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50155240
PNG
(CHEMBL3775773)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CCC(F)(F)C2)cc1
Show InChI InChI=1S/C23H21F2N5O/c1-29-13-18(12-26-29)16-4-2-15(3-5-16)10-21-19-11-17(6-7-20(19)27-28-21)22(31)30-9-8-23(24,25)14-30/h2-7,11-13H,8-10,14H2,1H3,(H,27,28)
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n/an/a 5n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50155239
PNG
(CHEMBL3775935)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CCCC2)cc1
Show InChI InChI=1S/C23H23N5O/c1-27-15-19(14-24-27)17-6-4-16(5-7-17)12-22-20-13-18(8-9-21(20)25-26-22)23(29)28-10-2-3-11-28/h4-9,13-15H,2-3,10-12H2,1H3,(H,25,26)
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n/an/a 5n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154940
PNG
(CHEMBL3775384)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CCCCC2)cc1
Show InChI InChI=1S/C24H25N5O/c1-28-16-20(15-25-28)18-7-5-17(6-8-18)13-23-21-14-19(9-10-22(21)26-27-23)24(30)29-11-3-2-4-12-29/h5-10,14-16H,2-4,11-13H2,1H3,(H,26,27)
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n/an/a 6n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154956
PNG
(CHEMBL3775317)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CC[C@@H](O)C2)cc1 |r|
Show InChI InChI=1S/C23H23N5O2/c1-27-13-18(12-24-27)16-4-2-15(3-5-16)10-22-20-11-17(6-7-21(20)25-26-22)23(30)28-9-8-19(29)14-28/h2-7,11-13,19,29H,8-10,14H2,1H3,(H,25,26)/t19-/m1/s1
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n/an/a 6n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Binding affinity to CDK8/Cyclin C (unknown origin) by reporter displacement assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50155238
PNG
(CHEMBL3774402)
Show SMILES COC1CN(C1)C(=O)c1ccc2[nH]nc(Cc3ccc(cc3)-c3cnn(C)c3)c2c1
Show InChI InChI=1S/C23H23N5O2/c1-27-12-18(11-24-27)16-5-3-15(4-6-16)9-22-20-10-17(7-8-21(20)25-26-22)23(29)28-13-19(14-28)30-2/h3-8,10-12,19H,9,13-14H2,1-2H3,(H,25,26)
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n/an/a 6n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154964
PNG
(CHEMBL3775134)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CC(F)(F)C2)cc1
Show InChI InChI=1S/C22H19F2N5O/c1-28-11-17(10-25-28)15-4-2-14(3-5-15)8-20-18-9-16(6-7-19(18)26-27-20)21(30)29-12-22(23,24)13-29/h2-7,9-11H,8,12-13H2,1H3,(H,26,27)
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n/an/a 7n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154961
PNG
(CHEMBL3774959)
Show SMILES COC1CN(C1)C(=O)c1ccc2[nH]nc(Cc3ccc4n(C)ncc4c3)c2c1
Show InChI InChI=1S/C21H21N5O2/c1-25-20-6-3-13(7-15(20)10-22-25)8-19-17-9-14(4-5-18(17)23-24-19)21(27)26-11-16(12-26)28-2/h3-7,9-10,16H,8,11-12H2,1-2H3,(H,23,24)
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n/an/a 7n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154939
PNG
(CHEMBL3775562)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CCNCC2)cc1
Show InChI InChI=1S/C23H24N6O/c1-28-15-19(14-25-28)17-4-2-16(3-5-17)12-22-20-13-18(6-7-21(20)26-27-22)23(30)29-10-8-24-9-11-29/h2-7,13-15,24H,8-12H2,1H3,(H,26,27)
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n/an/a 7n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154963
PNG
(CHEMBL3775680)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)NC2CC2)cc1
Show InChI InChI=1S/C22H21N5O/c1-27-13-17(12-23-27)15-4-2-14(3-5-15)10-21-19-11-16(6-9-20(19)25-26-21)22(28)24-18-7-8-18/h2-6,9,11-13,18H,7-8,10H2,1H3,(H,24,28)(H,25,26)
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n/an/a 8n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50155238
PNG
(CHEMBL3774402)
Show SMILES COC1CN(C1)C(=O)c1ccc2[nH]nc(Cc3ccc(cc3)-c3cnn(C)c3)c2c1
Show InChI InChI=1S/C23H23N5O2/c1-27-12-18(11-24-27)16-5-3-15(4-6-16)9-22-20-10-17(7-8-21(20)25-26-22)23(29)28-13-19(14-28)30-2/h3-8,10-12,19H,9,13-14H2,1-2H3,(H,25,26)
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n/an/a 9n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154943
PNG
(CHEMBL3775576)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc4n(C)ncc4c3)c2c1
Show InChI InChI=1S/C18H17N5O/c1-19-18(24)12-4-5-15-14(9-12)16(22-21-15)8-11-3-6-17-13(7-11)10-20-23(17)2/h3-7,9-10H,8H2,1-2H3,(H,19,24)(H,21,22)
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n/an/a 10n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50155241
PNG
(CHEMBL3774885)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CCOCC2)cc1
Show InChI InChI=1S/C23H23N5O2/c1-27-15-19(14-24-27)17-4-2-16(3-5-17)12-22-20-13-18(6-7-21(20)25-26-22)23(29)28-8-10-30-11-9-28/h2-7,13-15H,8-12H2,1H3,(H,25,26)
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n/an/a 11n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154940
PNG
(CHEMBL3775384)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CCCCC2)cc1
Show InChI InChI=1S/C24H25N5O/c1-28-16-20(15-25-28)18-7-5-17(6-8-18)13-23-21-14-19(9-10-22(21)26-27-23)24(30)29-11-3-2-4-12-29/h5-10,14-16H,2-4,11-13H2,1H3,(H,26,27)
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n/an/a 13n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154944
PNG
(CHEMBL3775535)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc(cc3)-c3cnn(C)c3)c2c1
Show InChI InChI=1S/C20H19N5O/c1-21-20(26)15-7-8-18-17(10-15)19(24-23-18)9-13-3-5-14(6-4-13)16-11-22-25(2)12-16/h3-8,10-12H,9H2,1-2H3,(H,21,26)(H,23,24)
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n/an/a 15n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154945
PNG
(CHEMBL3775775)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc(cc3)-c3cnn(CC(C)(C)O)c3)c2c1
Show InChI InChI=1S/C23H25N5O2/c1-23(2,30)14-28-13-18(12-25-28)16-6-4-15(5-7-16)10-21-19-11-17(22(29)24-3)8-9-20(19)26-27-21/h4-9,11-13,30H,10,14H2,1-3H3,(H,24,29)(H,26,27)
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n/an/a 16n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154961
PNG
(CHEMBL3774959)
Show SMILES COC1CN(C1)C(=O)c1ccc2[nH]nc(Cc3ccc4n(C)ncc4c3)c2c1
Show InChI InChI=1S/C21H21N5O2/c1-25-20-6-3-13(7-15(20)10-22-25)8-19-17-9-14(4-5-18(17)23-24-19)21(27)26-11-16(12-26)28-2/h3-7,9-10,16H,8,11-12H2,1-2H3,(H,23,24)
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n/an/a 18n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154964
PNG
(CHEMBL3775134)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CC(F)(F)C2)cc1
Show InChI InChI=1S/C22H19F2N5O/c1-28-11-17(10-25-28)15-4-2-14(3-5-15)8-20-18-9-16(6-7-19(18)26-27-20)21(30)29-12-22(23,24)13-29/h2-7,9-11H,8,12-13H2,1H3,(H,26,27)
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n/an/a 25n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50155240
PNG
(CHEMBL3775773)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CCC(F)(F)C2)cc1
Show InChI InChI=1S/C23H21F2N5O/c1-29-13-18(12-26-29)16-4-2-15(3-5-16)10-21-19-11-17(6-7-20(19)27-28-21)22(31)30-9-8-23(24,25)14-30/h2-7,11-13H,8-10,14H2,1H3,(H,27,28)
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n/an/a 27n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154949
PNG
(CHEMBL3775496)
Show SMILES CC(=O)Nc1ccc2[nH]nc(Cc3ccc(cc3)-c3cnn(C)c3)c2c1
Show InChI InChI=1S/C20H19N5O/c1-13(26)22-17-7-8-19-18(10-17)20(24-23-19)9-14-3-5-15(6-4-14)16-11-21-25(2)12-16/h3-8,10-12H,9H2,1-2H3,(H,22,26)(H,23,24)
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n/an/a 29n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154947
PNG
(CHEMBL3774757)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)-c2nccn2C)cc1
Show InChI InChI=1S/C22H20N6/c1-27-10-9-23-22(27)17-7-8-20-19(12-17)21(26-25-20)11-15-3-5-16(6-4-15)18-13-24-28(2)14-18/h3-10,12-14H,11H2,1-2H3,(H,25,26)
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n/an/a 32n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154951
PNG
(CHEMBL3775547)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)N2CCCC2=O)cc1
Show InChI InChI=1S/C22H21N5O/c1-26-14-17(13-23-26)16-6-4-15(5-7-16)11-21-19-12-18(8-9-20(19)24-25-21)27-10-2-3-22(27)28/h4-9,12-14H,2-3,10-11H2,1H3,(H,24,25)
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n/an/a 36n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154956
PNG
(CHEMBL3775317)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CC[C@@H](O)C2)cc1 |r|
Show InChI InChI=1S/C23H23N5O2/c1-27-13-18(12-24-27)16-4-2-15(3-5-16)10-22-20-11-17(6-7-21(20)25-26-22)23(30)28-9-8-19(29)14-28/h2-7,11-13,19,29H,8-10,14H2,1H3,(H,25,26)/t19-/m1/s1
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n/an/a 42n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154941
PNG
(CHEMBL3775024)
Show SMILES Cn1ncc2cc(Cc3n[nH]c4ccc(cc34)C(=O)N3CC[C@H](O)C3)ccc12 |r|
Show InChI InChI=1S/C21H21N5O2/c1-25-20-5-2-13(8-15(20)11-22-25)9-19-17-10-14(3-4-18(17)23-24-19)21(28)26-7-6-16(27)12-26/h2-5,8,10-11,16,27H,6-7,9,12H2,1H3,(H,23,24)/t16-/m0/s1
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n/an/a 43n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154943
PNG
(CHEMBL3775576)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc4n(C)ncc4c3)c2c1
Show InChI InChI=1S/C18H17N5O/c1-19-18(24)12-4-5-15-14(9-12)16(22-21-15)8-11-3-6-17-13(7-11)10-20-23(17)2/h3-7,9-10H,8H2,1-2H3,(H,19,24)(H,21,22)
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n/an/a 49n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8-mediated STAT1 phosphorylation at serine727 in human SW620 cells harboring APC mutant

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154955
PNG
(CHEMBL3775321)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CC[C@H](O)C2)cc1 |r|
Show InChI InChI=1S/C23H23N5O2/c1-27-13-18(12-24-27)16-4-2-15(3-5-16)10-22-20-11-17(6-7-21(20)25-26-22)23(30)28-9-8-19(29)14-28/h2-7,11-13,19,29H,8-10,14H2,1H3,(H,25,26)/t19-/m0/s1
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n/an/a 53n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154943
PNG
(CHEMBL3775576)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc4n(C)ncc4c3)c2c1
Show InChI InChI=1S/C18H17N5O/c1-19-18(24)12-4-5-15-14(9-12)16(22-21-15)8-11-3-6-17-13(7-11)10-20-23(17)2/h3-7,9-10H,8H2,1-2H3,(H,19,24)(H,21,22)
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n/an/a 53n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Binding affinity to CDK8/Cyclin C (unknown origin) by reporter displacement assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154944
PNG
(CHEMBL3775535)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc(cc3)-c3cnn(C)c3)c2c1
Show InChI InChI=1S/C20H19N5O/c1-21-20(26)15-7-8-18-17(10-15)19(24-23-18)9-13-3-5-14(6-4-13)16-11-22-25(2)12-16/h3-8,10-12H,9H2,1-2H3,(H,21,26)(H,23,24)
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n/an/a 55n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154942
PNG
(CHEMBL3775076)
Show SMILES Cn1ncc2cc(Cc3n[nH]c4ccc(cc34)C(=O)N3CCC(F)(F)C3)ccc12
Show InChI InChI=1S/C21H19F2N5O/c1-27-19-5-2-13(8-15(19)11-24-27)9-18-16-10-14(3-4-17(16)25-26-18)20(29)28-7-6-21(22,23)12-28/h2-5,8,10-11H,6-7,9,12H2,1H3,(H,25,26)
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n/an/a 56n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154943
PNG
(CHEMBL3775576)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc4n(C)ncc4c3)c2c1
Show InChI InChI=1S/C18H17N5O/c1-19-18(24)12-4-5-15-14(9-12)16(22-21-15)8-11-3-6-17-13(7-11)10-20-23(17)2/h3-7,9-10H,8H2,1-2H3,(H,19,24)(H,21,22)
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n/an/a 65n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154950
PNG
(CHEMBL3774400)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(NS(C)(=O)=O)cc23)cc1
Show InChI InChI=1S/C19H19N5O2S/c1-24-12-15(11-20-24)14-5-3-13(4-6-14)9-19-17-10-16(23-27(2,25)26)7-8-18(17)21-22-19/h3-8,10-12,23H,9H2,1-2H3,(H,21,22)
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n/an/a 73n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154945
PNG
(CHEMBL3775775)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc(cc3)-c3cnn(CC(C)(C)O)c3)c2c1
Show InChI InChI=1S/C23H25N5O2/c1-23(2,30)14-28-13-18(12-25-28)16-6-4-15(5-7-16)10-21-19-11-17(22(29)24-3)8-9-20(19)26-27-21/h4-9,11-13,30H,10,14H2,1-3H3,(H,24,29)(H,26,27)
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n/an/a 76n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154946
PNG
(CHEMBL3775519)
Show SMILES Cn1cnc(c1)-c1ccc2[nH]nc(Cc3ccc(cc3)-c3cnn(C)c3)c2c1
Show InChI InChI=1S/C22H20N6/c1-27-13-22(23-14-27)17-7-8-20-19(10-17)21(26-25-20)9-15-3-5-16(6-4-15)18-11-24-28(2)12-18/h3-8,10-14H,9H2,1-2H3,(H,25,26)
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n/an/a 78n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154951
PNG
(CHEMBL3775547)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)N2CCCC2=O)cc1
Show InChI InChI=1S/C22H21N5O/c1-26-14-17(13-23-26)16-6-4-15(5-7-16)11-21-19-12-18(8-9-20(19)24-25-21)27-10-2-3-22(27)28/h4-9,12-14H,2-3,10-11H2,1H3,(H,24,25)
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n/an/a 82n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154965
PNG
(CHEMBL3775423)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CC(O)C2)cc1
Show InChI InChI=1S/C22H21N5O2/c1-26-11-17(10-23-26)15-4-2-14(3-5-15)8-21-19-9-16(6-7-20(19)24-25-21)22(29)27-12-18(28)13-27/h2-7,9-11,18,28H,8,12-13H2,1H3,(H,24,25)
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n/an/a 94n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154963
PNG
(CHEMBL3775680)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)NC2CC2)cc1
Show InChI InChI=1S/C22H21N5O/c1-27-13-17(12-23-27)15-4-2-14(3-5-15)10-21-19-11-16(6-9-20(19)25-26-21)22(28)24-18-7-8-18/h2-6,9,11-13,18H,7-8,10H2,1H3,(H,24,28)(H,25,26)
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n/an/a 100n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154962
PNG
(CHEMBL3775614)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(N)=O)cc1
Show InChI InChI=1S/C19H17N5O/c1-24-11-15(10-21-24)13-4-2-12(3-5-13)8-18-16-9-14(19(20)25)6-7-17(16)22-23-18/h2-7,9-11H,8H2,1H3,(H2,20,25)(H,22,23)
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n/an/a 110n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154949
PNG
(CHEMBL3775496)
Show SMILES CC(=O)Nc1ccc2[nH]nc(Cc3ccc(cc3)-c3cnn(C)c3)c2c1
Show InChI InChI=1S/C20H19N5O/c1-13(26)22-17-7-8-19-18(10-17)20(24-23-19)9-14-3-5-15(6-4-14)16-11-21-25(2)12-16/h3-8,10-12H,9H2,1-2H3,(H,22,26)(H,23,24)
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n/an/a 110n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154939
PNG
(CHEMBL3775562)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)N2CCNCC2)cc1
Show InChI InChI=1S/C23H24N6O/c1-28-15-19(14-25-28)17-4-2-16(3-5-17)12-22-20-13-18(6-7-21(20)26-27-22)23(30)29-10-8-24-9-11-29/h2-7,13-15,24H,8-12H2,1H3,(H,26,27)
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n/an/a 140n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154960
PNG
(CHEMBL3775123)
Show SMILES Cn1ncc2cc(Cc3n[nH]c4ccc(cc34)C(=O)N3CC(O)C3)ccc12
Show InChI InChI=1S/C20H19N5O2/c1-24-19-5-2-12(6-14(19)9-21-24)7-18-16-8-13(3-4-17(16)22-23-18)20(27)25-10-15(26)11-25/h2-6,8-9,15,26H,7,10-11H2,1H3,(H,22,23)
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n/an/a 160n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154958
PNG
(CHEMBL3775910)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3cccc(C)c3)c2c1
Show InChI InChI=1S/C17H17N3O/c1-11-4-3-5-12(8-11)9-16-14-10-13(17(21)18-2)6-7-15(14)19-20-16/h3-8,10H,9H2,1-2H3,(H,18,21)(H,19,20)
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n/an/a 170n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154954
PNG
(CHEMBL3774509)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)S(=O)(=O)NC2CC2)cc1
Show InChI InChI=1S/C21H21N5O2S/c1-26-13-16(12-22-26)15-4-2-14(3-5-15)10-21-19-11-18(8-9-20(19)23-24-21)29(27,28)25-17-6-7-17/h2-5,8-9,11-13,17,25H,6-7,10H2,1H3,(H,23,24)
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n/an/a 180n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154946
PNG
(CHEMBL3775519)
Show SMILES Cn1cnc(c1)-c1ccc2[nH]nc(Cc3ccc(cc3)-c3cnn(C)c3)c2c1
Show InChI InChI=1S/C22H20N6/c1-27-13-22(23-14-27)17-7-8-20-19(10-17)21(26-25-20)9-15-3-5-16(6-4-15)18-11-24-28(2)12-18/h3-8,10-14H,9H2,1-2H3,(H,25,26)
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n/an/a 200n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))		BDBM50154943
PNG
(CHEMBL3775576)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc4n(C)ncc4c3)c2c1
Show InChI InChI=1S/C18H17N5O/c1-19-18(24)12-4-5-15-14(9-12)16(22-21-15)8-11-3-6-17-13(7-11)10-20-23(17)2/h3-7,9-10H,8H2,1-2H3,(H,19,24)(H,21,22)
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n/an/a 240n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of 5HT2A (unknown origin)

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
PAS domain-containing serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50154943
PNG
(CHEMBL3775576)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc4n(C)ncc4c3)c2c1
Show InChI InChI=1S/C18H17N5O/c1-19-18(24)12-4-5-15-14(9-12)16(22-21-15)8-11-3-6-17-13(7-11)10-20-23(17)2/h3-7,9-10H,8H2,1-2H3,(H,19,24)(H,21,22)
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n/an/a 260n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of PASK (unknown origin)

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154962
PNG
(CHEMBL3775614)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(N)=O)cc1
Show InChI InChI=1S/C19H17N5O/c1-24-11-15(10-21-24)13-4-2-12(3-5-13)8-18-16-9-14(19(20)25)6-7-17(16)22-23-18/h2-7,9-11H,8H2,1H3,(H2,20,25)(H,22,23)
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n/an/a 270n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154948
PNG
(CHEMBL3775895)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)-c2cc(N)ccn2)cc1
Show InChI InChI=1S/C23H20N6/c1-29-14-18(13-26-29)16-4-2-15(3-5-16)10-23-20-11-17(6-7-21(20)27-28-23)22-12-19(24)8-9-25-22/h2-9,11-14H,10H2,1H3,(H2,24,25)(H,27,28)
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n/an/a 270n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154959
PNG
(CHEMBL3774945)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc4cnn(C)c4c3)c2c1
Show InChI InChI=1S/C18H17N5O/c1-19-18(24)12-5-6-15-14(9-12)16(22-21-15)7-11-3-4-13-10-20-23(2)17(13)8-11/h3-6,8-10H,7H2,1-2H3,(H,19,24)(H,21,22)
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n/an/a 280n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154954
PNG
(CHEMBL3774509)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)S(=O)(=O)NC2CC2)cc1
Show InChI InChI=1S/C21H21N5O2S/c1-26-13-16(12-22-26)15-4-2-14(3-5-15)10-21-19-11-18(8-9-20(19)23-24-21)29(27,28)25-17-6-7-17/h2-5,8-9,11-13,17,25H,6-7,10H2,1H3,(H,23,24)
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n/an/a 313n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154943
PNG
(CHEMBL3775576)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc4n(C)ncc4c3)c2c1
Show InChI InChI=1S/C18H17N5O/c1-19-18(24)12-4-5-15-14(9-12)16(22-21-15)8-11-3-6-17-13(7-11)10-20-23(17)2/h3-7,9-10H,8H2,1-2H3,(H,19,24)(H,21,22)
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n/an/a 340n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8-dependent WNT signalling in human LS174T cells in absence of WNT ligand

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154952
PNG
(CHEMBL3775578)
Show SMILES CC(=O)NCCNc1ccc2[nH]nc(Cc3ccc(cc3)-c3cnn(C)c3)c2c1
Show InChI InChI=1S/C22H24N6O/c1-15(29)23-9-10-24-19-7-8-21-20(12-19)22(27-26-21)11-16-3-5-17(6-4-16)18-13-25-28(2)14-18/h3-8,12-14,24H,9-11H2,1-2H3,(H,23,29)(H,26,27)
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n/an/a 680n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154950
PNG
(CHEMBL3774400)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(NS(C)(=O)=O)cc23)cc1
Show InChI InChI=1S/C19H19N5O2S/c1-24-12-15(11-20-24)14-5-3-13(4-6-14)9-19-17-10-16(23-27(2,25)26)7-8-18(17)21-22-19/h3-8,10-12,23H,9H2,1-2H3,(H,21,22)
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n/an/a 710n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154943
PNG
(CHEMBL3775576)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc4n(C)ncc4c3)c2c1
Show InChI InChI=1S/C18H17N5O/c1-19-18(24)12-4-5-15-14(9-12)16(22-21-15)8-11-3-6-17-13(7-11)10-20-23(17)2/h3-7,9-10H,8H2,1-2H3,(H,19,24)(H,21,22)
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n/an/a 710n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8-dependent WNT signalling in human LS174T cells in presence of WNT3a ligand

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C/Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154938
PNG
(CHEMBL3774874)
Show SMILES CNC(=O)c1ccc2[nH]nc(CC(C)C)c2c1
Show InChI InChI=1S/C13H17N3O/c1-8(2)6-12-10-7-9(13(17)14-3)4-5-11(10)15-16-12/h4-5,7-8H,6H2,1-3H3,(H,14,17)(H,15,16)
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n/an/a 840n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154948
PNG
(CHEMBL3775895)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)-c2cc(N)ccn2)cc1
Show InChI InChI=1S/C23H20N6/c1-29-14-18(13-26-29)16-4-2-15(3-5-16)10-23-20-11-17(6-7-21(20)27-28-23)22-12-19(24)8-9-25-22/h2-9,11-14H,10H2,1H3,(H2,24,25)(H,27,28)
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n/an/a 1.50E+3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154958
PNG
(CHEMBL3775910)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3cccc(C)c3)c2c1
Show InChI InChI=1S/C17H17N3O/c1-11-4-3-5-12(8-11)9-16-14-10-13(17(21)18-2)6-7-15(14)19-20-16/h3-8,10H,9H2,1-2H3,(H,18,21)(H,19,20)
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n/an/a 1.90E+3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154947
PNG
(CHEMBL3774757)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)-c2nccn2C)cc1
Show InChI InChI=1S/C22H20N6/c1-27-10-9-23-22(27)17-7-8-20-19(12-17)21(26-25-20)11-15-3-5-16(6-4-15)18-13-24-28(2)14-18/h3-10,12-14H,11H2,1-2H3,(H,25,26)
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n/an/a 1.90E+3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154959
PNG
(CHEMBL3774945)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc4cnn(C)c4c3)c2c1
Show InChI InChI=1S/C18H17N5O/c1-19-18(24)12-5-6-15-14(9-12)16(22-21-15)7-11-3-4-13-10-20-23(2)17(13)8-11/h3-6,8-10H,7H2,1-2H3,(H,19,24)(H,21,22)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154957
PNG
(CHEMBL3775049)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc(OC)c(OC)c3)c2c1
Show InChI InChI=1S/C18H19N3O3/c1-19-18(22)12-5-6-14-13(10-12)15(21-20-14)8-11-4-7-16(23-2)17(9-11)24-3/h4-7,9-10H,8H2,1-3H3,(H,19,22)(H,20,21)
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n/an/a 2.50E+3n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154957
PNG
(CHEMBL3775049)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc(OC)c(OC)c3)c2c1
Show InChI InChI=1S/C18H19N3O3/c1-19-18(22)12-5-6-14-13(10-12)15(21-20-14)8-11-4-7-16(23-2)17(9-11)24-3/h4-7,9-10H,8H2,1-3H3,(H,19,22)(H,20,21)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154938
PNG
(CHEMBL3774874)
Show SMILES CNC(=O)c1ccc2[nH]nc(CC(C)C)c2c1
Show InChI InChI=1S/C13H17N3O/c1-8(2)6-12-10-7-9(13(17)14-3)4-5-11(10)15-16-12/h4-5,7-8H,6H2,1-3H3,(H,14,17)(H,15,16)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154952
PNG
(CHEMBL3775578)
Show SMILES CC(=O)NCCNc1ccc2[nH]nc(Cc3ccc(cc3)-c3cnn(C)c3)c2c1
Show InChI InChI=1S/C22H24N6O/c1-15(29)23-9-10-24-19-7-8-21-20(12-19)22(27-26-21)11-16-3-5-17(6-4-16)18-13-25-28(2)14-18/h3-8,12-14,24H,9-11H2,1-2H3,(H,23,29)(H,26,27)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM50154943
PNG
(CHEMBL3775576)
Show SMILES CNC(=O)c1ccc2[nH]nc(Cc3ccc4n(C)ncc4c3)c2c1
Show InChI InChI=1S/C18H17N5O/c1-19-18(24)12-4-5-15-14(9-12)16(22-21-15)8-11-3-6-17-13(7-11)10-20-23(17)2/h3-7,9-10H,8H2,1-2H3,(H,19,24)(H,21,22)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of human ERG

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 8


(Homo sapiens (Human))		BDBM50154953
PNG
(CHEMBL3774744)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)N2CCOCC2)cc1
Show InChI InChI=1S/C22H23N5O/c1-26-15-18(14-23-26)17-4-2-16(3-5-17)12-22-20-13-19(6-7-21(20)24-25-22)27-8-10-28-11-9-27/h2-7,13-15H,8-12H2,1H3,(H,24,25)
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n/an/a>3.00E+4n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
Cyclin-C


(Homo sapiens (Human))		BDBM50154953
PNG
(CHEMBL3774744)
Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)N2CCOCC2)cc1
Show InChI InChI=1S/C22H23N5O/c1-26-15-18(14-23-26)17-4-2-16(3-5-17)12-22-20-13-19(6-7-21(20)24-25-22)27-8-10-28-11-9-27/h2-7,13-15H,8-12H2,1H3,(H,24,25)
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n/an/a>3.00E+4n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay

Bioorg Med Chem Lett 26: 1443-51 (2016)


Article DOI: 10.1016/j.bmcl.2016.01.062
BindingDB Entry DOI: 10.7270/Q2NZ89G6
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%