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Compile Data Set for Download or QSAR

Found 61 hits Enz. Inhib. hit(s) with all data for entry = 50013704   
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-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133557
PNG
(1-[2-(2,6-Dichloro-benzyl)-thiazol-4-yl]-3-morphol...)
Show SMILES Clc1cccc(Cl)c1Cc1nc(NC(=O)NN2CCOCC2)cs1
Show InChI InChI=1S/C15H16Cl2N4O2S/c16-11-2-1-3-12(17)10(11)8-14-18-13(9-24-14)19-15(22)20-21-4-6-23-7-5-21/h1-3,9H,4-8H2,(H2,19,20,22)
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500n/an/an/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Inhibition of Tau Protein Kinase II (TPK II)


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133573
PNG
(CHEMBL119530 | N-[2-(2,6-dichlorobenzyl)-1,3-thiaz...)
Show SMILES Clc1cccc(Cl)c1Cc1nc(NC(=O)NOc2ccccc2)cs1
Show InChI InChI=1S/C17H13Cl2N3O2S/c18-13-7-4-8-14(19)12(13)9-16-20-15(10-25-16)21-17(23)22-24-11-5-2-1-3-6-11/h1-8,10H,9H2,(H2,21,22,23)
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n/an/a 900n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133557
PNG
(1-[2-(2,6-Dichloro-benzyl)-thiazol-4-yl]-3-morphol...)
Show SMILES Clc1cccc(Cl)c1Cc1nc(NC(=O)NN2CCOCC2)cs1
Show InChI InChI=1S/C15H16Cl2N4O2S/c16-11-2-1-3-12(17)10(11)8-14-18-13(9-24-14)19-15(22)20-21-4-6-23-7-5-21/h1-3,9H,4-8H2,(H2,19,20,22)
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n/an/a 1.00E+3n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133579
PNG
(CHEMBL117950 | N-(tert-butoxy)-N'-[2-(2,6-dichloro...)
Show SMILES CC(C)(C)ONC(=O)Nc1csc(Cc2c(Cl)cccc2Cl)n1
Show InChI InChI=1S/C15H17Cl2N3O2S/c1-15(2,3)22-20-14(21)19-12-8-23-13(18-12)7-9-10(16)5-4-6-11(9)17/h4-6,8H,7H2,1-3H3,(H2,19,20,21)
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n/an/a 1.00E+3n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133564
PNG
(1-[2-(2,6-Dichloro-benzyl)-thiazol-4-yl]-3-pyrroli...)
Show SMILES Clc1cccc(Cl)c1Cc1nc(NC(=O)NN2CCCC2)cs1
Show InChI InChI=1S/C15H16Cl2N4OS/c16-11-4-3-5-12(17)10(11)8-14-18-13(9-23-14)19-15(22)20-21-6-1-2-7-21/h3-5,9H,1-2,6-8H2,(H2,19,20,22)
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n/an/a 3.00E+3n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133575
PNG
(CHEMBL119041 | N-[2-(2,6-dichlorobenzyl)-1,3-thiaz...)
Show SMILES Clc1cccc(Cl)c1Cc1nc(NC(=O)NOC2CCCCO2)cs1
Show InChI InChI=1S/C16H17Cl2N3O3S/c17-11-4-3-5-12(18)10(11)8-14-19-13(9-25-14)20-16(22)21-24-15-6-1-2-7-23-15/h3-5,9,15H,1-2,6-8H2,(H2,20,21,22)
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n/an/a 3.00E+3n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133551
PNG
(CHEMBL119143 | N-[2-(2,6-dichlorobenzyl)-1,3-thiaz...)
Show SMILES CN(C)NC(=O)Nc1csc(Cc2c(Cl)cccc2Cl)n1
Show InChI InChI=1S/C13H14Cl2N4OS/c1-19(2)18-13(20)17-11-7-21-12(16-11)6-8-9(14)4-3-5-10(8)15/h3-5,7H,6H2,1-2H3,(H2,17,18,20)
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n/an/a 4.00E+3n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133569
PNG
(1-Morpholin-4-yl-3-[2-(pyridine-2-sulfonylmethyl)-...)
Show SMILES O=C(NN1CCOCC1)Nc1csc(CS(=O)(=O)c2ccccn2)n1
Show InChI InChI=1S/C14H17N5O4S2/c20-14(18-19-5-7-23-8-6-19)17-11-9-24-12(16-11)10-25(21,22)13-3-1-2-4-15-13/h1-4,9H,5-8,10H2,(H2,17,18,20)
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n/an/a 5.00E+3n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133580
PNG
(CHEMBL119796 | N-[2-(2,6-dichlorobenzyl)-1,3-thiaz...)
Show SMILES CCONC(=O)Nc1csc(Cc2c(Cl)cccc2Cl)n1
Show InChI InChI=1S/C13H13Cl2N3O2S/c1-2-20-18-13(19)17-11-7-21-12(16-11)6-8-9(14)4-3-5-10(8)15/h3-5,7H,2,6H2,1H3,(H2,17,18,19)
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n/an/a 5.00E+3n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133566
PNG
(CHEMBL117778 | N-{2-[(methylsulfonyl)methyl]-1,3-t...)
Show SMILES CS(=O)(=O)Cc1nc(NC(=O)NOc2ccccc2)cs1
Show InChI InChI=1S/C12H13N3O4S2/c1-21(17,18)8-11-13-10(7-20-11)14-12(16)15-19-9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H2,14,15,16)
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n/an/a 6.00E+3n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133567
PNG
(CHEMBL118685 | N-(allyloxy)-N'-[2-(2,6-dichloroben...)
Show SMILES Clc1cccc(Cl)c1Cc1nc(NC(=O)NOCC=C)cs1
Show InChI InChI=1S/C14H13Cl2N3O2S/c1-2-6-21-19-14(20)18-12-8-22-13(17-12)7-9-10(15)4-3-5-11(9)16/h2-5,8H,1,6-7H2,(H2,18,19,20)
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n/an/a 6.00E+3n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133556
PNG
(1-Morpholin-4-yl-3-(2-phenyl-thiazol-4-yl)-urea | ...)
Show SMILES O=C(NN1CCOCC1)Nc1csc(n1)-c1ccccc1
Show InChI InChI=1S/C14H16N4O2S/c19-14(17-18-6-8-20-9-7-18)16-12-10-21-13(15-12)11-4-2-1-3-5-11/h1-5,10H,6-9H2,(H2,16,17,19)
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n/an/a 6.00E+3n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133555
PNG
(1-[2-(2,6-Dichloro-benzyl)-thiazol-4-yl]-3-piperid...)
Show SMILES Clc1cccc(Cl)c1Cc1nc(NC(=O)NN2CCCCC2)cs1
Show InChI InChI=1S/C16H18Cl2N4OS/c17-12-5-4-6-13(18)11(12)9-15-19-14(10-24-15)20-16(23)21-22-7-2-1-3-8-22/h4-6,10H,1-3,7-9H2,(H2,20,21,23)
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n/an/a 6.00E+3n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133576
PNG
(CHEMBL116615 | N-phenoxy-N'-(2-phenyl-1,3-thiazol-...)
Show SMILES O=C(NOc1ccccc1)Nc1csc(n1)-c1ccccc1
Show InChI InChI=1S/C16H13N3O2S/c20-16(19-21-13-9-5-2-6-10-13)18-14-11-22-15(17-14)12-7-3-1-4-8-12/h1-11H,(H2,18,19,20)
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n/an/a 8.00E+3n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133549
PNG
(CHEMBL117800 | N-[2-(2,6-dichlorobenzyl)-1,3-thiaz...)
Show SMILES CONC(=O)Nc1csc(Cc2c(Cl)cccc2Cl)n1
Show InChI InChI=1S/C12H11Cl2N3O2S/c1-19-17-12(18)16-10-6-20-11(15-10)5-7-8(13)3-2-4-9(7)14/h2-4,6H,5H2,1H3,(H2,16,17,18)
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n/an/a 9.00E+3n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133556
PNG
(1-Morpholin-4-yl-3-(2-phenyl-thiazol-4-yl)-urea | ...)
Show SMILES O=C(NN1CCOCC1)Nc1csc(n1)-c1ccccc1
Show InChI InChI=1S/C14H16N4O2S/c19-14(17-18-6-8-20-9-7-18)16-12-10-21-13(15-12)11-4-2-1-3-5-11/h1-5,10H,6-9H2,(H2,16,17,19)
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n/an/a 9.00E+3n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133551
PNG
(CHEMBL119143 | N-[2-(2,6-dichlorobenzyl)-1,3-thiaz...)
Show SMILES CN(C)NC(=O)Nc1csc(Cc2c(Cl)cccc2Cl)n1
Show InChI InChI=1S/C13H14Cl2N4OS/c1-19(2)18-13(20)17-11-7-21-12(16-11)6-8-9(14)4-3-5-10(8)15/h3-5,7H,6H2,1-2H3,(H2,17,18,20)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133559
PNG
(1-Morpholin-4-yl-3-(2-thiophen-2-yl-thiazol-4-yl)-...)
Show SMILES O=C(NN1CCOCC1)Nc1csc(n1)-c1cccs1
Show InChI InChI=1S/C12H14N4O2S2/c17-12(15-16-3-5-18-6-4-16)14-10-8-20-11(13-10)9-2-1-7-19-9/h1-2,7-8H,3-6H2,(H2,14,15,17)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133574
PNG
(1-Azepan-1-yl-3-[2-(2,6-dichloro-benzyl)-thiazol-4...)
Show SMILES Clc1cccc(Cl)c1Cc1nc(NC(=O)NN2CCCCCC2)cs1
Show InChI InChI=1S/C17H20Cl2N4OS/c18-13-6-5-7-14(19)12(13)10-16-20-15(11-25-16)21-17(24)22-23-8-3-1-2-4-9-23/h5-7,11H,1-4,8-10H2,(H2,21,22,24)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133557
PNG
(1-[2-(2,6-Dichloro-benzyl)-thiazol-4-yl]-3-morphol...)
Show SMILES Clc1cccc(Cl)c1Cc1nc(NC(=O)NN2CCOCC2)cs1
Show InChI InChI=1S/C15H16Cl2N4O2S/c16-11-2-1-3-12(17)10(11)8-14-18-13(9-24-14)19-15(22)20-21-4-6-23-7-5-21/h1-3,9H,4-8H2,(H2,19,20,22)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133569
PNG
(1-Morpholin-4-yl-3-[2-(pyridine-2-sulfonylmethyl)-...)
Show SMILES O=C(NN1CCOCC1)Nc1csc(CS(=O)(=O)c2ccccn2)n1
Show InChI InChI=1S/C14H17N5O4S2/c20-14(18-19-5-7-23-8-6-19)17-11-9-24-12(16-11)10-25(21,22)13-3-1-2-4-15-13/h1-4,9H,5-8,10H2,(H2,17,18,20)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133565
PNG
(CHEMBL116339 | N-[2-(2,6-dichlorobenzyl)-1,3-thiaz...)
Show SMILES CN(NC(=O)Nc1csc(Cc2c(Cl)cccc2Cl)n1)c1ccccc1
Show InChI InChI=1S/C18H16Cl2N4OS/c1-24(12-6-3-2-4-7-12)23-18(25)22-16-11-26-17(21-16)10-13-14(19)8-5-9-15(13)20/h2-9,11H,10H2,1H3,(H2,22,23,25)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133568
PNG
(1-[2-(2-Chloro-phenyl)-thiazol-4-yl]-3-morpholin-4...)
Show SMILES Clc1ccccc1-c1nc(NC(=O)NN2CCOCC2)cs1
Show InChI InChI=1S/C14H15ClN4O2S/c15-11-4-2-1-3-10(11)13-16-12(9-22-13)17-14(20)18-19-5-7-21-8-6-19/h1-4,9H,5-8H2,(H2,17,18,20)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133579
PNG
(CHEMBL117950 | N-(tert-butoxy)-N'-[2-(2,6-dichloro...)
Show SMILES CC(C)(C)ONC(=O)Nc1csc(Cc2c(Cl)cccc2Cl)n1
Show InChI InChI=1S/C15H17Cl2N3O2S/c1-15(2,3)22-20-14(21)19-12-8-23-13(18-12)7-9-10(16)5-4-6-11(9)17/h4-6,8H,7H2,1-3H3,(H2,19,20,21)
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n/an/a 1.50E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133560
PNG
(CHEMBL117779 | N-[2-(3-methylphenyl)-1,3-thiazol-4...)
Show SMILES Cc1cccc(c1)-c1nc(NC(=O)NOc2ccccc2)cs1
Show InChI InChI=1S/C17H15N3O2S/c1-12-6-5-7-13(10-12)16-18-15(11-23-16)19-17(21)20-22-14-8-3-2-4-9-14/h2-11H,1H3,(H2,19,20,21)
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n/an/a 1.60E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133550
PNG
(1-[2-(4-Methoxy-phenoxymethyl)-thiazol-4-yl]-3-mor...)
Show SMILES COc1ccc(OCc2nc(NC(=O)NN3CCOCC3)cs2)cc1
Show InChI InChI=1S/C16H20N4O4S/c1-22-12-2-4-13(5-3-12)24-10-15-17-14(11-25-15)18-16(21)19-20-6-8-23-9-7-20/h2-5,11H,6-10H2,1H3,(H2,18,19,21)
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n/an/a 2.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133553
PNG
(1-Morpholin-4-yl-3-(2-m-tolyl-thiazol-4-yl)-urea |...)
Show SMILES Cc1cccc(c1)-c1nc(NC(=O)NN2CCOCC2)cs1
Show InChI InChI=1S/C15H18N4O2S/c1-11-3-2-4-12(9-11)14-16-13(10-22-14)17-15(20)18-19-5-7-21-8-6-19/h2-4,9-10H,5-8H2,1H3,(H2,17,18,20)
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n/an/a 2.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133564
PNG
(1-[2-(2,6-Dichloro-benzyl)-thiazol-4-yl]-3-pyrroli...)
Show SMILES Clc1cccc(Cl)c1Cc1nc(NC(=O)NN2CCCC2)cs1
Show InChI InChI=1S/C15H16Cl2N4OS/c16-11-4-3-5-12(17)10(11)8-14-18-13(9-23-14)19-15(22)20-21-6-1-2-7-21/h3-5,9H,1-2,6-8H2,(H2,19,20,22)
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n/an/a 2.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133580
PNG
(CHEMBL119796 | N-[2-(2,6-dichlorobenzyl)-1,3-thiaz...)
Show SMILES CCONC(=O)Nc1csc(Cc2c(Cl)cccc2Cl)n1
Show InChI InChI=1S/C13H13Cl2N3O2S/c1-2-20-18-13(19)17-11-7-21-12(16-11)6-8-9(14)4-3-5-10(8)15/h3-5,7H,2,6H2,1H3,(H2,17,18,19)
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n/an/a 2.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133552
PNG
(CHEMBL325452 | N-(2-benzyl-1,3-thiazol-4-yl)-N'-ph...)
Show SMILES O=C(NOc1ccccc1)Nc1csc(Cc2ccccc2)n1
Show InChI InChI=1S/C17H15N3O2S/c21-17(20-22-14-9-5-2-6-10-14)19-15-12-23-16(18-15)11-13-7-3-1-4-8-13/h1-10,12H,11H2,(H2,19,20,21)
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n/an/a 2.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133577
PNG
(1-Morpholin-4-yl-3-(2-phenylsulfanylmethyl-thiazol...)
Show SMILES O=C(NN1CCOCC1)Nc1csc(CSc2ccccc2)n1
Show InChI InChI=1S/C15H18N4O2S2/c20-15(18-19-6-8-21-9-7-19)17-13-10-23-14(16-13)11-22-12-4-2-1-3-5-12/h1-5,10H,6-9,11H2,(H2,17,18,20)
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n/an/a 3.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133559
PNG
(1-Morpholin-4-yl-3-(2-thiophen-2-yl-thiazol-4-yl)-...)
Show SMILES O=C(NN1CCOCC1)Nc1csc(n1)-c1cccs1
Show InChI InChI=1S/C12H14N4O2S2/c17-12(15-16-3-5-18-6-4-16)14-10-8-20-11(13-10)9-2-1-7-19-9/h1-2,7-8H,3-6H2,(H2,14,15,17)
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n/an/a 3.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133577
PNG
(1-Morpholin-4-yl-3-(2-phenylsulfanylmethyl-thiazol...)
Show SMILES O=C(NN1CCOCC1)Nc1csc(CSc2ccccc2)n1
Show InChI InChI=1S/C15H18N4O2S2/c20-15(18-19-6-8-21-9-7-19)17-13-10-23-14(16-13)11-22-12-4-2-1-3-5-12/h1-5,10H,6-9,11H2,(H2,17,18,20)
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n/an/a 3.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133568
PNG
(1-[2-(2-Chloro-phenyl)-thiazol-4-yl]-3-morpholin-4...)
Show SMILES Clc1ccccc1-c1nc(NC(=O)NN2CCOCC2)cs1
Show InChI InChI=1S/C14H15ClN4O2S/c15-11-4-2-1-3-10(11)13-16-12(9-22-13)17-14(20)18-19-5-7-21-8-6-19/h1-4,9H,5-8H2,(H2,17,18,20)
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n/an/a 3.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133553
PNG
(1-Morpholin-4-yl-3-(2-m-tolyl-thiazol-4-yl)-urea |...)
Show SMILES Cc1cccc(c1)-c1nc(NC(=O)NN2CCOCC2)cs1
Show InChI InChI=1S/C15H18N4O2S/c1-11-3-2-4-12(9-11)14-16-13(10-22-14)17-15(20)18-19-5-7-21-8-6-19/h2-4,9-10H,5-8H2,1H3,(H2,17,18,20)
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n/an/a 3.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133550
PNG
(1-[2-(4-Methoxy-phenoxymethyl)-thiazol-4-yl]-3-mor...)
Show SMILES COc1ccc(OCc2nc(NC(=O)NN3CCOCC3)cs2)cc1
Show InChI InChI=1S/C16H20N4O4S/c1-22-12-2-4-13(5-3-12)24-10-15-17-14(11-25-15)18-16(21)19-20-6-8-23-9-7-20/h2-5,11H,6-10H2,1H3,(H2,18,19,21)
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n/an/a 3.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133555
PNG
(1-[2-(2,6-Dichloro-benzyl)-thiazol-4-yl]-3-piperid...)
Show SMILES Clc1cccc(Cl)c1Cc1nc(NC(=O)NN2CCCCC2)cs1
Show InChI InChI=1S/C16H18Cl2N4OS/c17-12-5-4-6-13(18)11(12)9-15-19-14(10-24-15)20-16(23)21-22-7-2-1-3-8-22/h4-6,10H,1-3,7-9H2,(H2,20,21,23)
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n/an/a 3.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133576
PNG
(CHEMBL116615 | N-phenoxy-N'-(2-phenyl-1,3-thiazol-...)
Show SMILES O=C(NOc1ccccc1)Nc1csc(n1)-c1ccccc1
Show InChI InChI=1S/C16H13N3O2S/c20-16(19-21-13-9-5-2-6-10-13)18-14-11-22-15(17-14)12-7-3-1-4-8-12/h1-11H,(H2,18,19,20)
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n/an/a 3.50E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133567
PNG
(CHEMBL118685 | N-(allyloxy)-N'-[2-(2,6-dichloroben...)
Show SMILES Clc1cccc(Cl)c1Cc1nc(NC(=O)NOCC=C)cs1
Show InChI InChI=1S/C14H13Cl2N3O2S/c1-2-6-21-19-14(20)18-12-8-22-13(17-12)7-9-10(15)4-3-5-11(9)16/h2-5,8H,1,6-7H2,(H2,18,19,20)
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n/an/a 4.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133554
PNG
(1-(2-Benzyl-thiazol-4-yl)-3-morpholin-4-yl-urea | ...)
Show SMILES O=C(NN1CCOCC1)Nc1csc(Cc2ccccc2)n1
Show InChI InChI=1S/C15H18N4O2S/c20-15(18-19-6-8-21-9-7-19)17-13-11-22-14(16-13)10-12-4-2-1-3-5-12/h1-5,11H,6-10H2,(H2,17,18,20)
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n/an/a 5.50E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133565
PNG
(CHEMBL116339 | N-[2-(2,6-dichlorobenzyl)-1,3-thiaz...)
Show SMILES CN(NC(=O)Nc1csc(Cc2c(Cl)cccc2Cl)n1)c1ccccc1
Show InChI InChI=1S/C18H16Cl2N4OS/c1-24(12-6-3-2-4-7-12)23-18(25)22-16-11-26-17(21-16)10-13-14(19)8-5-9-15(13)20/h2-9,11H,10H2,1H3,(H2,22,23,25)
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n/an/a 6.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133574
PNG
(1-Azepan-1-yl-3-[2-(2,6-dichloro-benzyl)-thiazol-4...)
Show SMILES Clc1cccc(Cl)c1Cc1nc(NC(=O)NN2CCCCCC2)cs1
Show InChI InChI=1S/C17H20Cl2N4OS/c18-13-6-5-7-14(19)12(13)10-16-20-15(11-25-16)21-17(24)22-23-8-3-1-2-4-9-23/h5-7,11H,1-4,8-10H2,(H2,21,22,24)
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n/an/a 7.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133561
PNG
(1-Morpholin-4-yl-3-(2-phenoxymethyl-thiazol-4-yl)-...)
Show SMILES O=C(NN1CCOCC1)Nc1csc(COc2ccccc2)n1
Show InChI InChI=1S/C15H18N4O3S/c20-15(18-19-6-8-21-9-7-19)17-13-11-23-14(16-13)10-22-12-4-2-1-3-5-12/h1-5,11H,6-10H2,(H2,17,18,20)
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n/an/a 8.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133566
PNG
(CHEMBL117778 | N-{2-[(methylsulfonyl)methyl]-1,3-t...)
Show SMILES CS(=O)(=O)Cc1nc(NC(=O)NOc2ccccc2)cs1
Show InChI InChI=1S/C12H13N3O4S2/c1-21(17,18)8-11-13-10(7-20-11)14-12(16)15-19-9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H2,14,15,16)
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n/an/a 9.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133575
PNG
(CHEMBL119041 | N-[2-(2,6-dichlorobenzyl)-1,3-thiaz...)
Show SMILES Clc1cccc(Cl)c1Cc1nc(NC(=O)NOC2CCCCO2)cs1
Show InChI InChI=1S/C16H17Cl2N3O3S/c17-11-4-3-5-12(18)10(11)8-14-19-13(9-25-14)20-16(22)21-24-15-6-1-2-7-23-15/h3-5,9,15H,1-2,6-8H2,(H2,20,21,22)
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n/an/a 9.00E+4n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133573
PNG
(CHEMBL119530 | N-[2-(2,6-dichlorobenzyl)-1,3-thiaz...)
Show SMILES Clc1cccc(Cl)c1Cc1nc(NC(=O)NOc2ccccc2)cs1
Show InChI InChI=1S/C17H13Cl2N3O2S/c18-13-7-4-8-14(19)12(13)9-16-20-15(10-25-16)21-17(23)22-24-11-5-2-1-3-6-11/h1-8,10H,9H2,(H2,21,22,23)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133582
PNG
(1-Morpholin-4-yl-3-(2-p-tolyl-thiazol-4-yl)-urea |...)
Show SMILES Cc1ccc(cc1)-c1nc(NC(=O)NN2CCOCC2)cs1
Show InChI InChI=1S/C15H18N4O2S/c1-11-2-4-12(5-3-11)14-16-13(10-22-14)17-15(20)18-19-6-8-21-9-7-19/h2-5,10H,6-9H2,1H3,(H2,17,18,20)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133563
PNG
(1-(2-Ethyl-thiazol-4-yl)-3-morpholin-4-yl-urea | C...)
Show SMILES CCc1nc(NC(=O)NN2CCOCC2)cs1
Show InChI InChI=1S/C10H16N4O2S/c1-2-9-11-8(7-17-9)12-10(15)13-14-3-5-16-6-4-14/h7H,2-6H2,1H3,(H2,12,13,15)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50133581
PNG
(1-[2-(4-Chloro-phenyl)-thiazol-4-yl]-3-morpholin-4...)
Show SMILES Clc1ccc(cc1)-c1nc(NC(=O)NN2CCOCC2)cs1
Show InChI InChI=1S/C14H15ClN4O2S/c15-11-3-1-10(2-4-11)13-16-12(9-22-13)17-14(20)18-19-5-7-21-8-6-19/h1-4,9H,5-8H2,(H2,17,18,20)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit Cyclin-dependent kinase 5-p35.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50133549
PNG
(CHEMBL117800 | N-[2-(2,6-dichlorobenzyl)-1,3-thiaz...)
Show SMILES CONC(=O)Nc1csc(Cc2c(Cl)cccc2Cl)n1
Show InChI InChI=1S/C12H11Cl2N3O2S/c1-19-17-12(18)16-10-6-20-11(15-10)5-7-8(13)3-2-4-9(7)14/h2-4,6H,5H2,1H3,(H2,16,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Ability to inhibit cyclin-dependent kinase 2-cyclin A.


Bioorg Med Chem Lett 13: 3491-5 (2003)


BindingDB Entry DOI: 10.7270/Q2XG9QHN
More data for this
Ligand-Target Pair
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