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Compile Data Set for Download or QSAR

Found 463 hits with Last Name = 'nourrisson' and Initial = 'mr'   
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
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM100152
PNG
(7-methoxy-1-methyl-9H-beta-carboline;hydrochloride...)
Show SMILES COc1ccc2c(c1)[nH]c1c(C)nccc21
Show InChI InChI=1S/C13H12N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-7,15H,1-2H3
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n/an/a 26n/an/an/an/an/an/a



Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CLK1-GST expressed in Escherichia coli using GRSRSRSRSRSR as substrate


Eur J Med Chem 59: 283-95 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.030
BindingDB Entry DOI: 10.7270/Q2K075K7
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(RAT)
BDBM100152
PNG
(7-methoxy-1-methyl-9H-beta-carboline;hydrochloride...)
Show SMILES COc1ccc2c(c1)[nH]c1c(C)nccc21
Show InChI InChI=1S/C13H12N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-7,15H,1-2H3
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n/an/a 29n/an/an/an/an/an/a



Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of rat recombinant DYRK1A-GST expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate


Eur J Med Chem 59: 283-95 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.030
BindingDB Entry DOI: 10.7270/Q2K075K7
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dual specificity protein kinase CLK1


(Mus musculus)
BDBM50568546
PNG
(CHEMBL4853288)
Show SMILES Nc1nccc(n1)-c1c(nc2c(N)nccn12)-c1ccc(F)cc1
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TBA

Assay Description
Inhibition of recombinant mouse CLK1 expressed in bacteria using GRSRSRSRSRSR as substrate in presence of [gamma-33P]ATP by radiometric assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50443934
PNG
(CHEMBL3091797)
Show SMILES Nc1ncnc2c1oc1cc(cnc21)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C15H8Cl2N4O/c16-8-1-2-9(10(17)4-8)7-3-11-12(19-5-7)13-14(22-11)15(18)21-6-20-13/h1-6H,(H2,18,20,21)
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UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate


Bioorg Med Chem Lett 23: 6784-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.019
BindingDB Entry DOI: 10.7270/Q2MC91HJ
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50070528
PNG
(CHEMBL3408804)
Show SMILES COc1ccc(c(F)c1)-c1cnc2sc3c(N)ncnc3c2c1
Show InChI InChI=1S/C16H11FN4OS/c1-22-9-2-3-10(12(17)5-9)8-4-11-13-14(15(18)21-7-20-13)23-16(11)19-6-8/h2-7H,1H3,(H2,18,20,21)
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UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate after 30 mins


Eur J Med Chem 92: 124-34 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.038
BindingDB Entry DOI: 10.7270/Q2BR8TVG
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM100152
PNG
(7-methoxy-1-methyl-9H-beta-carboline;hydrochloride...)
Show SMILES COc1ccc2c(c1)[nH]c1c(C)nccc21
Show InChI InChI=1S/C13H12N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-7,15H,1-2H3
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n/an/a 80n/an/an/an/an/an/a



Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of DYRK1A (unknown origin)


Eur J Med Chem 59: 283-95 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.030
BindingDB Entry DOI: 10.7270/Q2K075K7
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50070560
PNG
(CHEMBL3408799)
Show SMILES Nc1ncnc2c3cc(cnc3sc12)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C15H8Cl2N4S/c16-8-1-2-9(11(17)4-8)7-3-10-12-13(14(18)21-6-20-12)22-15(10)19-5-7/h1-6H,(H2,18,20,21)
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UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate after 30 mins


Eur J Med Chem 92: 124-34 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.038
BindingDB Entry DOI: 10.7270/Q2BR8TVG
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50070504
PNG
(CHEMBL3408810)
Show SMILES Nc1ncnc2c3ccc(nc3sc12)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C15H8Cl2N4S/c16-7-1-2-8(10(17)5-7)11-4-3-9-12-13(22-15(9)21-11)14(18)20-6-19-12/h1-6H,(H2,18,19,20)
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UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate after 30 mins


Eur J Med Chem 92: 124-34 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.038
BindingDB Entry DOI: 10.7270/Q2BR8TVG
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50070547
PNG
(CHEMBL3408802)
Show SMILES Nc1ncnc2c3cc(cnc3sc12)-c1ccc(Cl)cc1F
Show InChI InChI=1S/C15H8ClFN4S/c16-8-1-2-9(11(17)4-8)7-3-10-12-13(14(18)21-6-20-12)22-15(10)19-5-7/h1-6H,(H2,18,20,21)
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UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate after 30 mins


Eur J Med Chem 92: 124-34 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.038
BindingDB Entry DOI: 10.7270/Q2BR8TVG
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50070553
PNG
(CHEMBL3408801)
Show SMILES Nc1ncnc2c3cc(cnc3sc12)-c1ccc(F)cc1F
Show InChI InChI=1S/C15H8F2N4S/c16-8-1-2-9(11(17)4-8)7-3-10-12-13(14(18)21-6-20-12)22-15(10)19-5-7/h1-6H,(H2,18,20,21)
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UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate after 30 mins


Eur J Med Chem 92: 124-34 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.038
BindingDB Entry DOI: 10.7270/Q2BR8TVG
More data for this
Ligand-Target Pair
Casein kinase I isoform epsilon


(Homo sapiens (Human))
BDBM50568544
PNG
(CHEMBL4870529)
Show SMILES CN(C)c1nccn2c(c(nc12)-c1ccc(F)cc1)-c1ccnc(N)n1
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TBA

Assay Description
Inhibition of recombinant human CK1 epsilon expressed in baculovirus infected Sf9 cells using RRKHAAIGSpAYSITA as substrate


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Mus musculus)
BDBM50568545
PNG
(CHEMBL4877608)
Show SMILES CSc1nccc(n1)-c1c(nc2c(N)nccn12)-c1ccc(F)cc1
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TBA

Assay Description
Inhibition of recombinant mouse CLK1 expressed in bacteria using GRSRSRSRSRSR as substrate in presence of [gamma-33P]ATP by radiometric assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2
More data for this
Ligand-Target Pair
Casein kinase I isoform epsilon


(Homo sapiens (Human))
BDBM50568545
PNG
(CHEMBL4877608)
Show SMILES CSc1nccc(n1)-c1c(nc2c(N)nccn12)-c1ccc(F)cc1
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TBA

Assay Description
Inhibition of recombinant human CK1 epsilon expressed in baculovirus infected Sf9 cells using RRKHAAIGSpAYSITA as substrate


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50070506
PNG
(CHEMBL3408808)
Show SMILES Nc1ncnc2c3cc(cnc3sc12)-c1cccs1
Show InChI InChI=1S/C13H8N4S2/c14-12-11-10(16-6-17-12)8-4-7(5-15-13(8)19-11)9-2-1-3-18-9/h1-6H,(H2,14,16,17)
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UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate after 30 mins


Eur J Med Chem 92: 124-34 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.038
BindingDB Entry DOI: 10.7270/Q2BR8TVG
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM27437
PNG
(12-phenyl-8-thia-3,5,10-triazatricyclo[7.4.0.0^{2,...)
Show SMILES Nc1ncnc2c3cc(cnc3sc12)-c1ccccc1
Show InChI InChI=1S/C15H10N4S/c16-14-13-12(18-8-19-14)11-6-10(7-17-15(11)20-13)9-4-2-1-3-5-9/h1-8H,(H2,16,18,19)
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UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate after 30 mins


Eur J Med Chem 92: 124-34 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.038
BindingDB Entry DOI: 10.7270/Q2BR8TVG
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50070529
PNG
(CHEMBL3408803)
Show SMILES Nc1ncnc2c3cc(cnc3sc12)-c1ccc(F)cc1Cl
Show InChI InChI=1S/C15H8ClFN4S/c16-11-4-8(17)1-2-9(11)7-3-10-12-13(14(18)21-6-20-12)22-15(10)19-5-7/h1-6H,(H2,18,20,21)
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UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate after 30 mins


Eur J Med Chem 92: 124-34 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.038
BindingDB Entry DOI: 10.7270/Q2BR8TVG
More data for this
Ligand-Target Pair
Casein kinase I isoform epsilon


(Homo sapiens (Human))
BDBM50568546
PNG
(CHEMBL4853288)
Show SMILES Nc1nccc(n1)-c1c(nc2c(N)nccn12)-c1ccc(F)cc1
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TBA

Assay Description
Inhibition of recombinant human CK1 epsilon expressed in baculovirus infected Sf9 cells using RRKHAAIGSpAYSITA as substrate


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Mus musculus)
BDBM50568544
PNG
(CHEMBL4870529)
Show SMILES CN(C)c1nccn2c(c(nc12)-c1ccc(F)cc1)-c1ccnc(N)n1
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TBA

Assay Description
Inhibition of recombinant mouse CLK1 expressed in bacteria using GRSRSRSRSRSR as substrate in presence of [gamma-33P]ATP by radiometric assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50070578
PNG
(CHEMBL3408795)
Show SMILES COc1ccc(cc1)-c1cnc2sc3c(N)ncnc3c2c1
Show InChI InChI=1S/C16H12N4OS/c1-21-11-4-2-9(3-5-11)10-6-12-13-14(15(17)20-8-19-13)22-16(12)18-7-10/h2-8H,1H3,(H2,17,19,20)
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UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate after 30 mins


Eur J Med Chem 92: 124-34 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.038
BindingDB Entry DOI: 10.7270/Q2BR8TVG
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50443933
PNG
(CHEMBL3091798)
Show SMILES Nc1ncnc2c1oc1cc(cnc21)-c1ccc2OCOc2c1
Show InChI InChI=1S/C16H10N4O3/c17-16-15-14(19-6-20-16)13-12(23-15)4-9(5-18-13)8-1-2-10-11(3-8)22-7-21-10/h1-6H,7H2,(H2,17,19,20)
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UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate


Bioorg Med Chem Lett 23: 6784-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.019
BindingDB Entry DOI: 10.7270/Q2MC91HJ
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(RAT)
BDBM50070529
PNG
(CHEMBL3408803)
Show SMILES Nc1ncnc2c3cc(cnc3sc12)-c1ccc(F)cc1Cl
Show InChI InChI=1S/C15H8ClFN4S/c16-11-4-8(17)1-2-9(11)7-3-10-12-13(14(18)21-6-20-12)22-15(10)19-5-7/h1-6H,(H2,18,20,21)
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UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of rat recombinant GST-tagged DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate after 30 mins by scintillation counti...


Eur J Med Chem 92: 124-34 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.038
BindingDB Entry DOI: 10.7270/Q2BR8TVG
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50424711
PNG
(CHEMBL2314163)
Show SMILES COc1ccc2c(c1)oc1c(N)ncnc21
Show InChI InChI=1S/C11H9N3O2/c1-15-6-2-3-7-8(4-6)16-10-9(7)13-5-14-11(10)12/h2-5H,1H3,(H2,12,13,14)
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Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CLK1-GST expressed in Escherichia coli using GRSRSRSRSRSR as substrate


Eur J Med Chem 59: 283-95 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.030
BindingDB Entry DOI: 10.7270/Q2K075K7
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(RAT)
BDBM50424676
PNG
(CHEMBL2313912)
Show SMILES COc1ccc2c(c1)sc1c(Nc3ccc4OCCOc4c3)ncnc21
Show InChI InChI=1S/C19H15N3O3S/c1-23-12-3-4-13-16(9-12)26-18-17(13)20-10-21-19(18)22-11-2-5-14-15(8-11)25-7-6-24-14/h2-5,8-10H,6-7H2,1H3,(H,20,21,22)
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Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of rat recombinant DYRK1A-GST expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate


Eur J Med Chem 59: 283-95 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.030
BindingDB Entry DOI: 10.7270/Q2K075K7
More data for this
Ligand-Target Pair
Cyclin-T1/Cyclin-dependent kinase 9


(Homo sapiens (Human))
BDBM50568546
PNG
(CHEMBL4853288)
Show SMILES Nc1nccc(n1)-c1c(nc2c(N)nccn12)-c1ccc(F)cc1
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n/an/a 500n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human recombinant CDK9/CyclinT expressed in baculovirus infected Sf9 cells using YSPTSPSYSPTSPSYSPTSPSKKK as substrate in presence of [...


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50070508
PNG
(CHEMBL3408806)
Show SMILES Nc1ncnc2c1sc1ncc(cc21)-c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C15H9N5O2S/c16-14-13-12(18-7-19-14)11-5-9(6-17-15(11)23-13)8-1-3-10(4-2-8)20(21)22/h1-7H,(H2,16,18,19)
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n/an/a 500n/an/an/an/an/an/a



UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate after 30 mins


Eur J Med Chem 92: 124-34 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.038
BindingDB Entry DOI: 10.7270/Q2BR8TVG
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50070507
PNG
(CHEMBL3408807)
Show SMILES Nc1ncnc2c3cc(cnc3sc12)-c1ccc2OCOc2c1
Show InChI InChI=1S/C16H10N4O2S/c17-15-14-13(19-6-20-15)10-3-9(5-18-16(10)23-14)8-1-2-11-12(4-8)22-7-21-11/h1-6H,7H2,(H2,17,19,20)
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n/an/a 520n/an/an/an/an/an/a



UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate after 30 mins


Eur J Med Chem 92: 124-34 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.038
BindingDB Entry DOI: 10.7270/Q2BR8TVG
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(RAT)
BDBM50070560
PNG
(CHEMBL3408799)
Show SMILES Nc1ncnc2c3cc(cnc3sc12)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C15H8Cl2N4S/c16-8-1-2-9(11(17)4-8)7-3-10-12-13(14(18)21-6-20-12)22-15(10)19-5-7/h1-6H,(H2,18,20,21)
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n/an/a 530n/an/an/an/an/an/a



UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of rat recombinant GST-tagged DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate after 30 mins by scintillation counti...


Eur J Med Chem 92: 124-34 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.038
BindingDB Entry DOI: 10.7270/Q2BR8TVG
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Mus musculus)
BDBM50568541
PNG
(CHEMBL4860872)
Show SMILES CN(C)c1nccn2c(c(nc12)-c1ccccc1)-c1ccnc(N)n1
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TBA

Assay Description
Inhibition of recombinant mouse CLK1 expressed in bacteria using GRSRSRSRSRSR as substrate in presence of [gamma-33P]ATP by radiometric assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(RAT)
BDBM50443934
PNG
(CHEMBL3091797)
Show SMILES Nc1ncnc2c1oc1cc(cnc21)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C15H8Cl2N4O/c16-8-1-2-9(10(17)4-8)7-3-11-12(19-5-7)13-14(22-11)15(18)21-6-20-13/h1-6H,(H2,18,20,21)
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n/an/a 600n/an/an/an/an/an/a



UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of rat recombinant GST-tagged DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate after 30 mins by scintillation counti...


Bioorg Med Chem Lett 23: 6784-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.019
BindingDB Entry DOI: 10.7270/Q2MC91HJ
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50443938
PNG
(CHEMBL3091818)
Show SMILES Cc1ccc(cc1)-c1cnc2c(c1)oc1c(N)ncnc21
Show InChI InChI=1S/C16H12N4O/c1-9-2-4-10(5-3-9)11-6-12-13(18-7-11)14-15(21-12)16(17)20-8-19-14/h2-8H,1H3,(H2,17,19,20)
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n/an/a 610n/an/an/an/an/an/a



UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate


Bioorg Med Chem Lett 23: 6784-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.019
BindingDB Entry DOI: 10.7270/Q2MC91HJ
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(RAT)
BDBM50424671
PNG
(CHEMBL2313917)
Show SMILES COc1ccc2c(c1)sc1c(Nc3ccccc3Cl)ncnc21
Show InChI InChI=1S/C17H12ClN3OS/c1-22-10-6-7-11-14(8-10)23-16-15(11)19-9-20-17(16)21-13-5-3-2-4-12(13)18/h2-9H,1H3,(H,19,20,21)
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n/an/a 610n/an/an/an/an/an/a



Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of rat recombinant DYRK1A-GST expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate


Eur J Med Chem 59: 283-95 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.030
BindingDB Entry DOI: 10.7270/Q2K075K7
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(RAT)
BDBM50424660
PNG
(CHEMBL2313884)
Show SMILES COc1ccc2c(c1)sc1c(Nc3ccc(cc3)N(C)C)ncnc21
Show InChI InChI=1S/C19H18N4OS/c1-23(2)13-6-4-12(5-7-13)22-19-18-17(20-11-21-19)15-9-8-14(24-3)10-16(15)25-18/h4-11H,1-3H3,(H,20,21,22)
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n/an/a 660n/an/an/an/an/an/a



Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of rat recombinant DYRK1A-GST expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate


Eur J Med Chem 59: 283-95 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.030
BindingDB Entry DOI: 10.7270/Q2K075K7
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50424676
PNG
(CHEMBL2313912)
Show SMILES COc1ccc2c(c1)sc1c(Nc3ccc4OCCOc4c3)ncnc21
Show InChI InChI=1S/C19H15N3O3S/c1-23-12-3-4-13-16(9-12)26-18-17(13)20-10-21-19(18)22-11-2-5-14-15(8-11)25-7-6-24-14/h2-5,8-10H,6-7H2,1H3,(H,20,21,22)
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n/an/a 680n/an/an/an/an/an/a



Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CLK1-GST expressed in Escherichia coli using GRSRSRSRSRSR as substrate


Eur J Med Chem 59: 283-95 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.030
BindingDB Entry DOI: 10.7270/Q2K075K7
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM27439
PNG
(8-thia-3,5,10-triazatricyclo[7.4.0.0^{2,7}]trideca...)
Show SMILES Nc1ncnc2c3cccnc3sc12
Show InChI InChI=1S/C9H6N4S/c10-8-7-6(12-4-13-8)5-2-1-3-11-9(5)14-7/h1-4H,(H2,10,12,13)
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n/an/a 680n/an/an/an/an/an/a



Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate and [gamma32P]ATP after 30 mins by scin...


Eur J Med Chem 58: 171-83 (2012)


Article DOI: 10.1016/j.ejmech.2012.10.006
BindingDB Entry DOI: 10.7270/Q21G0NCJ
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50443939
PNG
(CHEMBL3091817)
Show SMILES Nc1ncnc2c3ncc(cc3oc12)-c1ccccc1
Show InChI InChI=1S/C15H10N4O/c16-15-14-13(18-8-19-15)12-11(20-14)6-10(7-17-12)9-4-2-1-3-5-9/h1-8H,(H2,16,18,19)
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n/an/a 690n/an/an/an/an/an/a



UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate


Bioorg Med Chem Lett 23: 6784-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.019
BindingDB Entry DOI: 10.7270/Q2MC91HJ
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50070562
PNG
(CHEMBL3408797)
Show SMILES Nc1ncnc2c3cc(cnc3sc12)-c1cccc(Cl)c1
Show InChI InChI=1S/C15H9ClN4S/c16-10-3-1-2-8(4-10)9-5-11-12-13(14(17)20-7-19-12)21-15(11)18-6-9/h1-7H,(H2,17,19,20)
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n/an/a 690n/an/an/an/an/an/a



UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate after 30 mins


Eur J Med Chem 92: 124-34 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.038
BindingDB Entry DOI: 10.7270/Q2BR8TVG
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(RAT)
BDBM50424663
PNG
(CHEMBL2313925)
Show SMILES COc1ccc(Nc2ncnc3c4ccc(OC)cc4sc23)c(F)c1
Show InChI InChI=1S/C18H14FN3O2S/c1-23-10-4-6-14(13(19)7-10)22-18-17-16(20-9-21-18)12-5-3-11(24-2)8-15(12)25-17/h3-9H,1-2H3,(H,20,21,22)
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n/an/a 710n/an/an/an/an/an/a



Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of rat recombinant DYRK1A-GST expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate


Eur J Med Chem 59: 283-95 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.030
BindingDB Entry DOI: 10.7270/Q2K075K7
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(RAT)
BDBM50424664
PNG
(CHEMBL2313924)
Show SMILES COc1ccc2c(c1)sc1c(Nc3ccc(Br)cc3F)ncnc21
Show InChI InChI=1S/C17H11BrFN3OS/c1-23-10-3-4-11-14(7-10)24-16-15(11)20-8-21-17(16)22-13-5-2-9(18)6-12(13)19/h2-8H,1H3,(H,20,21,22)
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n/an/a 710n/an/an/an/an/an/a



Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of rat recombinant DYRK1A-GST expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate


Eur J Med Chem 59: 283-95 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.030
BindingDB Entry DOI: 10.7270/Q2K075K7
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50424660
PNG
(CHEMBL2313884)
Show SMILES COc1ccc2c(c1)sc1c(Nc3ccc(cc3)N(C)C)ncnc21
Show InChI InChI=1S/C19H18N4OS/c1-23(2)13-6-4-12(5-7-13)22-19-18-17(20-11-21-19)15-9-8-14(24-3)10-16(15)25-18/h4-11H,1-3H3,(H,20,21,22)
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n/an/a 790n/an/an/an/an/an/a



Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CLK1-GST expressed in Escherichia coli using GRSRSRSRSRSR as substrate


Eur J Med Chem 59: 283-95 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.030
BindingDB Entry DOI: 10.7270/Q2K075K7
More data for this
Ligand-Target Pair
Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50568546
PNG
(CHEMBL4853288)
Show SMILES Nc1nccc(n1)-c1c(nc2c(N)nccn12)-c1ccc(F)cc1
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TBA

Assay Description
Inhibition of human CDK2/ cyclinA using histone H1 as substrate in presence of [gamma-33P]ATP by radiometric assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 3


(Homo sapiens (Human))
BDBM100152
PNG
(7-methoxy-1-methyl-9H-beta-carboline;hydrochloride...)
Show SMILES COc1ccc2c(c1)[nH]c1c(C)nccc21
Show InChI InChI=1S/C13H12N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-7,15H,1-2H3
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n/an/a 800n/an/an/an/an/an/a



Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of DYRK3 (unknown origin)


Eur J Med Chem 59: 283-95 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.030
BindingDB Entry DOI: 10.7270/Q2K075K7
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(RAT)
BDBM50424707
PNG
(CHEMBL2314167)
Show SMILES COc1ccc(Nc2ncnc3c4ccc(OC)cc4oc23)cc1
Show InChI InChI=1S/C18H15N3O3/c1-22-12-5-3-11(4-6-12)21-18-17-16(19-10-20-18)14-8-7-13(23-2)9-15(14)24-17/h3-10H,1-2H3,(H,19,20,21)
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n/an/a 880n/an/an/an/an/an/a



Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of rat recombinant DYRK1A-GST expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate


Eur J Med Chem 59: 283-95 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.030
BindingDB Entry DOI: 10.7270/Q2K075K7
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(RAT)
BDBM50392636
PNG
(CHEMBL2153529)
Show SMILES Fc1cc(Br)ccc1Nc1ncnc2c3cccnc3sc12
Show InChI InChI=1S/C15H8BrFN4S/c16-8-3-4-11(10(17)6-8)21-14-13-12(19-7-20-14)9-2-1-5-18-15(9)22-13/h1-7H,(H,19,20,21)
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n/an/a 890n/an/an/an/an/an/a



Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of rat recombinant GST-tagged DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma32P]ATP after 30 mins by sc...


Eur J Med Chem 58: 171-83 (2012)


Article DOI: 10.1016/j.ejmech.2012.10.006
BindingDB Entry DOI: 10.7270/Q21G0NCJ
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Mus musculus)
BDBM50568540
PNG
(CHEMBL4872681)
Show SMILES CSc1nccc(n1)-c1c(nc2c(nccn12)N(C)C)-c1ccccc1
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TBA

Assay Description
Inhibition of recombinant mouse CLK1 expressed in bacteria using GRSRSRSRSRSR as substrate in presence of [gamma-33P]ATP by radiometric assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 2


(Homo sapiens (Human))
BDBM100152
PNG
(7-methoxy-1-methyl-9H-beta-carboline;hydrochloride...)
Show SMILES COc1ccc2c(c1)[nH]c1c(C)nccc21
Show InChI InChI=1S/C13H12N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-7,15H,1-2H3
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n/an/a 900n/an/an/an/an/an/a



Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of DYRK2 (unknown origin)


Eur J Med Chem 59: 283-95 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.030
BindingDB Entry DOI: 10.7270/Q2K075K7
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50070527
PNG
(CHEMBL3408805)
Show SMILES Nc1ncnc2c3cc(cnc3sc12)-c1ccc(Br)cc1
Show InChI InChI=1S/C15H9BrN4S/c16-10-3-1-8(2-4-10)9-5-11-12-13(14(17)20-7-19-12)21-15(11)18-6-9/h1-7H,(H2,17,19,20)
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n/an/a 910n/an/an/an/an/an/a



UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate after 30 mins


Eur J Med Chem 92: 124-34 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.038
BindingDB Entry DOI: 10.7270/Q2BR8TVG
More data for this
Ligand-Target Pair
Casein kinase I isoform epsilon


(Homo sapiens (Human))
BDBM50568538
PNG
(CHEMBL3634367)
Show SMILES CN(C)c1nccn2c(c(nc12)-c1ccc(F)cc1)-c1ccncc1
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n/an/a 920n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human CK1 epsilon expressed in baculovirus infected Sf9 cells using RRKHAAIGSpAYSITA as substrate


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(RAT)
BDBM50424680
PNG
(CHEMBL2313908)
Show SMILES COc1ccc2c(c1)sc1c(Nc3ccc(OC)c(OC)c3)ncnc21
Show InChI InChI=1S/C19H17N3O3S/c1-23-12-5-6-13-16(9-12)26-18-17(13)20-10-21-19(18)22-11-4-7-14(24-2)15(8-11)25-3/h4-10H,1-3H3,(H,20,21,22)
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n/an/a 930n/an/an/an/an/an/a



Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of rat recombinant DYRK1A-GST expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate


Eur J Med Chem 59: 283-95 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.030
BindingDB Entry DOI: 10.7270/Q2K075K7
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(RAT)
BDBM50424665
PNG
(CHEMBL2313923)
Show SMILES COc1ccc2c(c1)sc1c(Nc3ccc(F)cc3F)ncnc21
Show InChI InChI=1S/C17H11F2N3OS/c1-23-10-3-4-11-14(7-10)24-16-15(11)20-8-21-17(16)22-13-5-2-9(18)6-12(13)19/h2-8H,1H3,(H,20,21,22)
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n/an/a 930n/an/an/an/an/an/a



Universit£ de Rouen

Curated by ChEMBL


Assay Description
Inhibition of rat recombinant DYRK1A-GST expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate


Eur J Med Chem 59: 283-95 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.030
BindingDB Entry DOI: 10.7270/Q2K075K7
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM50070505
PNG
(CHEMBL3408809)
Show SMILES Nc1ncnc2c3cc(cnc3sc12)-c1cncnc1
Show InChI InChI=1S/C13H8N6S/c14-12-11-10(18-6-19-12)9-1-7(4-17-13(9)20-11)8-2-15-5-16-3-8/h1-6H,(H2,14,18,19)
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n/an/a 950n/an/an/an/an/an/a



UMR 6014& FR 3038; Univ Rouen; INSA Rouen; CNRS

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged CLK1 expressed in Escherichia coli using GRSRSRSRSRSR as substrate after 30 mins


Eur J Med Chem 92: 124-34 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.038
BindingDB Entry DOI: 10.7270/Q2BR8TVG
More data for this
Ligand-Target Pair
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