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Compile Data Set for Download or QSAR

Found 76 hits of Enz. Inhib. data with enzyme = 'Cyclin-Dependent Kinase 2 (CDK2)' and Substrate = 'Biotinylated peptide substrate'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8144
PNG
(N-(3,5-difluorophenyl)-4-{pyrazolo[1,5-a]pyridazin...)
Show SMILES Fc1cc(F)cc(Nc2nccc(n2)-c2cnn3ncccc23)c1
Show InChI InChI=1S/C16H10F2N6/c17-10-6-11(18)8-12(7-10)22-16-19-5-3-14(23-16)13-9-21-24-15(13)2-1-4-20-24/h1-9H,(H,19,22,23)
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n/an/a 1n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8146
PNG
(N-(3,5-dimethylphenyl)-4-{pyrazolo[1,5-a]pyridazin...)
Show SMILES Cc1cc(C)cc(Nc2nccc(n2)-c2cnn3ncccc23)c1
Show InChI InChI=1S/C18H16N6/c1-12-8-13(2)10-14(9-12)22-18-19-7-5-16(23-18)15-11-21-24-17(15)4-3-6-20-24/h3-11H,1-2H3,(H,19,22,23)
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n/an/a 3n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8163
PNG
(N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{6-methylpy...)
Show SMILES Cc1ccc2c(cnn2n1)-c1ccnc(Nc2ccc3OCCOc3c2)n1
Show InChI InChI=1S/C19H16N6O2/c1-12-2-4-16-14(11-21-25(16)24-12)15-6-7-20-19(23-15)22-13-3-5-17-18(10-13)27-9-8-26-17/h2-7,10-11H,8-9H2,1H3,(H,20,22,23)
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n/an/a 6n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8147
PNG
(3-(2-{[3-(Trifluoromethyl)phenyl]amino}-4-pyrimidi...)
Show SMILES FC(F)(F)c1cccc(Nc2nccc(n2)-c2cnn3[nH]c(=O)ccc23)c1
Show InChI InChI=1S/C17H11F3N6O/c18-17(19,20)10-2-1-3-11(8-10)23-16-21-7-6-13(24-16)12-9-22-26-14(12)4-5-15(27)25-26/h1-9H,(H,25,27)(H,21,23,24)
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n/an/a 8n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8143
PNG
(N-[3-bromo-5-(trifluoromethyl)phenyl]-4-{pyrazolo[...)
Show SMILES FC(F)(F)c1cc(Br)cc(Nc2nccc(n2)-c2cnn3ncccc23)c1
Show InChI InChI=1S/C17H10BrF3N6/c18-11-6-10(17(19,20)21)7-12(8-11)25-16-22-5-3-14(26-16)13-9-24-27-15(13)2-1-4-23-27/h1-9H,(H,22,25,26)
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n/an/a 12n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8141
PNG
(N-(3,5-dimethoxycyclohexa-1,3-dien-1-yl)-4-{pyrazo...)
Show SMILES COC1CC(OC)=CC(C1)=Nc1nccc(n1)-c1cnn2ncccc12
Show InChI InChI=1S/C18H18N6O2/c1-25-13-8-12(9-14(10-13)26-2)22-18-19-7-5-16(23-18)15-11-21-24-17(15)4-3-6-20-24/h3-8,11,14H,9-10H2,1-2H3
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n/an/a 15n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8142
PNG
(N-[3-methoxy-5-(trifluoromethyl)phenyl]-4-{pyrazol...)
Show SMILES COc1cc(Nc2nccc(n2)-c2cnn3ncccc23)cc(c1)C(F)(F)F
Show InChI InChI=1S/C18H13F3N6O/c1-28-13-8-11(18(19,20)21)7-12(9-13)25-17-22-6-4-15(26-17)14-10-24-27-16(14)3-2-5-23-27/h2-10H,1H3,(H,22,25,26)
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n/an/a 15n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8154
PNG
(4-{6-methoxypyrazolo[1,5-a]pyridazin-3-yl}-N-(4-ni...)
Show SMILES COc1ccc2c(cnn2n1)-c1ccnc(Nc2ccc(cc2)N(=O)=O)n1
Show InChI InChI=1S/C17H13N7O3/c1-27-16-7-6-15-13(10-19-23(15)22-16)14-8-9-18-17(21-14)20-11-2-4-12(5-3-11)24(25)26/h2-10H,1H3,(H,18,20,21)
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n/an/a 20n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8162
PNG
(N-[3-methoxy-5-(trifluoromethyl)phenyl]-4-{6-methy...)
Show SMILES COc1cc(Nc2nccc(n2)-c2cnn3nc(C)ccc23)cc(c1)C(F)(F)F
Show InChI InChI=1S/C19H15F3N6O/c1-11-3-4-17-15(10-24-28(17)27-11)16-5-6-23-18(26-16)25-13-7-12(19(20,21)22)8-14(9-13)29-2/h3-10H,1-2H3,(H,23,25,26)
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n/an/a 20n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8160
PNG
(4-(6-Methylpyrazolo[1,5-b]pyridazin-3-yl)-N-[3-(tr...)
Show SMILES Cc1ccc2c(cnn2n1)-c1ccnc(Nc2cccc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C18H13F3N6/c1-11-5-6-16-14(10-23-27(16)26-11)15-7-8-22-17(25-15)24-13-4-2-3-12(9-13)18(19,20)21/h2-10H,1H3,(H,22,24,25)
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n/an/a 50n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8151
PNG
(N-(3-methoxyphenyl)-4-{6-methoxypyrazolo[1,5-a]pyr...)
Show SMILES COc1cccc(Nc2nccc(n2)-c2cnn3nc(OC)ccc23)c1
Show InChI InChI=1S/C18H16N6O2/c1-25-13-5-3-4-12(10-13)21-18-19-9-8-15(22-18)14-11-20-24-16(14)6-7-17(23-24)26-2/h3-11H,1-2H3,(H,19,21,22)
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n/an/a 63n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8159
PNG
(N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{6-methoxyp...)
Show SMILES COc1ccc2c(cnn2n1)-c1ccnc(Nc2ccc3OCCOc3c2)n1
Show InChI InChI=1S/C19H16N6O3/c1-26-18-5-3-15-13(11-21-25(15)24-18)14-6-7-20-19(23-14)22-12-2-4-16-17(10-12)28-9-8-27-16/h2-7,10-11H,8-9H2,1H3,(H,20,22,23)
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n/an/a 100n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8148
PNG
(4-[6-(Methyloxy)pyrazolo[1,5-b]pyridazin-3-yl]-N-[...)
Show SMILES COc1ccc2c(cnn2n1)-c1ccnc(Nc2cccc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C18H13F3N6O/c1-28-16-6-5-15-13(10-23-27(15)26-16)14-7-8-22-17(25-14)24-12-4-2-3-11(9-12)18(19,20)21/h2-10H,1H3,(H,22,24,25)
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n/an/a 160n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8155
PNG
(N-(3,5-dimethoxyphenyl)-4-{6-methoxypyrazolo[1,5-a...)
Show SMILES COc1cc(Nc2nccc(n2)-c2cnn3nc(OC)ccc23)cc(OC)c1
Show InChI InChI=1S/C19H18N6O3/c1-26-13-8-12(9-14(10-13)27-2)22-19-20-7-6-16(23-19)15-11-21-25-17(15)4-5-18(24-25)28-3/h4-11H,1-3H3,(H,20,22,23)
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n/an/a 199n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8161
PNG
(4-{6-methylpyrazolo[1,5-a]pyridazin-3-yl}-N-[4-(tr...)
Show SMILES Cc1ccc2c(cnn2n1)-c1ccnc(Nc2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C18H13F3N6/c1-11-2-7-16-14(10-23-27(16)26-11)15-8-9-22-17(25-15)24-13-5-3-12(4-6-13)18(19,20)21/h2-10H,1H3,(H,22,24,25)
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n/an/a 199n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8152
PNG
(4-{6-methoxypyrazolo[1,5-a]pyridazin-3-yl}-N-[3-(t...)
Show SMILES COc1ccc2c(cnn2n1)-c1ccnc(Nc2cccc(OC(F)(F)F)c2)n1
Show InChI InChI=1S/C18H13F3N6O2/c1-28-16-6-5-15-13(10-23-27(15)26-16)14-7-8-22-17(25-14)24-11-3-2-4-12(9-11)29-18(19,20)21/h2-10H,1H3,(H,22,24,25)
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n/an/a 199n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8145
PNG
(N-(3,5-dichlorophenyl)-4-{pyrazolo[1,5-a]pyridazin...)
Show SMILES Clc1cc(Cl)cc(Nc2nccc(n2)-c2cnn3ncccc23)c1
Show InChI InChI=1S/C16H10Cl2N6/c17-10-6-11(18)8-12(7-10)22-16-19-5-3-14(23-16)13-9-21-24-15(13)2-1-4-20-24/h1-9H,(H,19,22,23)
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n/an/a 316n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8153
PNG
(4-[(4-{6-methoxypyrazolo[1,5-a]pyridazin-3-yl}pyri...)
Show SMILES COc1ccc2c(cnn2n1)-c1ccnc(Nc2ccc(cc2)C#N)n1
Show InChI InChI=1S/C18H13N7O/c1-26-17-7-6-16-14(11-21-25(16)24-17)15-8-9-20-18(23-15)22-13-4-2-12(10-19)3-5-13/h2-9,11H,1H3,(H,20,22,23)
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n/an/a 501n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8156
PNG
(N-[3-methoxy-5-(trifluoromethyl)phenyl]-4-{6-metho...)
Show SMILES COc1cc(Nc2nccc(n2)-c2cnn3nc(OC)ccc23)cc(c1)C(F)(F)F
Show InChI InChI=1S/C19H15F3N6O2/c1-29-13-8-11(19(20,21)22)7-12(9-13)25-18-23-6-5-15(26-18)14-10-24-28-16(14)3-4-17(27-28)30-2/h3-10H,1-2H3,(H,23,25,26)
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n/an/a 794n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8150
PNG
(4-[6-(Propyloxy)pyrazolo[1,5-b]pyridazin-3-yl]-N-[...)
Show SMILES CCCOc1ccc2c(cnn2n1)-c1ccnc(Nc2cccc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C20H17F3N6O/c1-2-10-30-18-7-6-17-15(12-25-29(17)28-18)16-8-9-24-19(27-16)26-14-5-3-4-13(11-14)20(21,22)23/h3-9,11-12H,2,10H2,1H3,(H,24,26,27)
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n/an/a 1.26E+3n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8149
PNG
(4-[6-(Ethyloxy)pyrazolo[1,5-b]pyridazin-3-yl]-N-[3...)
Show SMILES CCOc1ccc2c(cnn2n1)-c1ccnc(Nc2cccc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C19H15F3N6O/c1-2-29-17-7-6-16-14(11-24-28(16)27-17)15-8-9-23-18(26-15)25-13-5-3-4-12(10-13)19(20,21)22/h3-11H,2H2,1H3,(H,23,25,26)
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n/an/a 2.00E+3n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8164
PNG
(4-(6-Phenylpyrazolo[1,5-b]pyridazin-3-yl)-N-[3-(tr...)
Show SMILES FC(F)(F)c1cccc(Nc2nccc(n2)-c2cnn3nc(ccc23)-c2ccccc2)c1
Show InChI InChI=1S/C23H15F3N6/c24-23(25,26)16-7-4-8-17(13-16)29-22-27-12-11-20(30-22)18-14-28-32-21(18)10-9-19(31-32)15-5-2-1-3-6-15/h1-14H,(H,27,29,30)
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n/an/a 2.50E+3n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8212
PNG
(4-(2-Cyclopropylpyrazolo[1,5-b]pyridazin-3-yl)-N-p...)
Show SMILES C1CC1c1nn2ncccc2c1-c1ccnc(Nc2ccccc2)n1
Show InChI InChI=1S/C19H16N6/c1-2-5-14(6-3-1)22-19-20-12-10-15(23-19)17-16-7-4-11-21-25(16)24-18(17)13-8-9-13/h1-7,10-13H,8-9H2,(H,20,22,23)
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n/an/a 3.98E+3n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8166
PNG
(N-phenyl-4-{2-phenylpyrazolo[1,5-a]pyridazin-3-yl}...)
Show SMILES N(c1ccccc1)c1nccc(n1)-c1c(nn2ncccc12)-c1ccccc1
Show InChI InChI=1S/C22H16N6/c1-3-8-16(9-4-1)21-20(19-12-7-14-24-28(19)27-21)18-13-15-23-22(26-18)25-17-10-5-2-6-11-17/h1-15H,(H,23,25,26)
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n/an/a 3.98E+3n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8204
PNG
(N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{6-methyl-2...)
Show SMILES Cc1ccc2c(c(nn2n1)-c1cccc(c1)C(F)(F)F)-c1ccnc(Nc2ccc3OCCOc3c2)n1
Show InChI InChI=1S/C26H19F3N6O2/c1-15-5-7-20-23(24(34-35(20)33-15)16-3-2-4-17(13-16)26(27,28)29)19-9-10-30-25(32-19)31-18-6-8-21-22(14-18)37-12-11-36-21/h2-10,13-14H,11-12H2,1H3,(H,30,31,32)
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n/an/a 5.00E+3n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8157
PNG
(4-{6-ethoxypyrazolo[1,5-a]pyridazin-3-yl}-N-[3-met...)
Show SMILES CCOc1ccc2c(cnn2n1)-c1ccnc(Nc2cc(OC)cc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C20H17F3N6O2/c1-3-31-18-5-4-17-15(11-25-29(17)28-18)16-6-7-24-19(27-16)26-13-8-12(20(21,22)23)9-14(10-13)30-2/h4-11H,3H2,1-2H3,(H,24,26,27)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8158
PNG
(N-[3,5-bis(trifluoromethyl)phenyl]-4-{6-methoxypyr...)
Show SMILES COc1ccc2c(cnn2n1)-c1ccnc(Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)n1
Show InChI InChI=1S/C19H12F6N6O/c1-32-16-3-2-15-13(9-27-31(15)30-16)14-4-5-26-17(29-14)28-12-7-10(18(20,21)22)6-11(8-12)19(23,24)25/h2-9H,1H3,(H,26,28,29)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8165
PNG
(N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{6-phenylpy...)
Show SMILES C1COc2cc(Nc3nccc(n3)-c3cnn4nc(ccc34)-c3ccccc3)ccc2O1
Show InChI InChI=1S/C24H18N6O2/c1-2-4-16(5-3-1)19-7-8-21-18(15-26-30(21)29-19)20-10-11-25-24(28-20)27-17-6-9-22-23(14-17)32-13-12-31-22/h1-11,14-15H,12-13H2,(H,25,27,28)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8167
PNG
(4-{2-phenylpyrazolo[1,5-a]pyridazin-3-yl}-N-[3-(tr...)
Show SMILES FC(F)(F)c1cccc(Nc2nccc(n2)-c2c(nn3ncccc23)-c2ccccc2)c1
Show InChI InChI=1S/C23H15F3N6/c24-23(25,26)16-8-4-9-17(14-16)29-22-27-13-11-18(30-22)20-19-10-5-12-28-32(19)31-21(20)15-6-2-1-3-7-15/h1-14H,(H,27,29,30)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8168
PNG
(N-(3,4-difluorophenyl)-4-{2-phenylpyrazolo[1,5-a]p...)
Show SMILES Fc1ccc(Nc2nccc(n2)-c2c(nn3ncccc23)-c2ccccc2)cc1F
Show InChI InChI=1S/C22H14F2N6/c23-16-9-8-15(13-17(16)24)27-22-25-12-10-18(28-22)20-19-7-4-11-26-30(19)29-21(20)14-5-2-1-3-6-14/h1-13H,(H,25,27,28)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8169
PNG
(N-(3,5-difluorophenyl)-4-{2-phenylpyrazolo[1,5-a]p...)
Show SMILES Fc1cc(F)cc(Nc2nccc(n2)-c2c(nn3ncccc23)-c2ccccc2)c1
Show InChI InChI=1S/C22H14F2N6/c23-15-11-16(24)13-17(12-15)27-22-25-10-8-18(28-22)20-19-7-4-9-26-30(19)29-21(20)14-5-2-1-3-6-14/h1-13H,(H,25,27,28)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8170
PNG
(N-[4-chloro-3-(trifluoromethyl)phenyl]-4-{2-phenyl...)
Show SMILES FC(F)(F)c1cc(Nc2nccc(n2)-c2c(nn3ncccc23)-c2ccccc2)ccc1Cl
Show InChI InChI=1S/C23H14ClF3N6/c24-17-9-8-15(13-16(17)23(25,26)27)30-22-28-12-10-18(31-22)20-19-7-4-11-29-33(19)32-21(20)14-5-2-1-3-6-14/h1-13H,(H,28,30,31)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8171
PNG
(N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{2-phenylpy...)
Show SMILES C1COc2cc(Nc3nccc(n3)-c3c(nn4ncccc34)-c3ccccc3)ccc2O1
Show InChI InChI=1S/C24H18N6O2/c1-2-5-16(6-3-1)23-22(19-7-4-11-26-30(19)29-23)18-10-12-25-24(28-18)27-17-8-9-20-21(15-17)32-14-13-31-20/h1-12,15H,13-14H2,(H,25,27,28)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8172
PNG
(4-[2-(4-Fluorophenyl)pyrazolo[1,5-b]pyridazin-3-yl...)
Show SMILES Fc1ccc(cc1)-c1nn2ncccc2c1-c1ccnc(Nc2ccccc2)n1
Show InChI InChI=1S/C22H15FN6/c23-16-10-8-15(9-11-16)21-20(19-7-4-13-25-29(19)28-21)18-12-14-24-22(27-18)26-17-5-2-1-3-6-17/h1-14H,(H,24,26,27)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8173
PNG
(4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridazin-3-yl...)
Show SMILES Fc1ccc(cc1)-c1nn2ncccc2c1-c1ccnc(Nc2cccc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C23H14F4N6/c24-16-8-6-14(7-9-16)21-20(19-5-2-11-29-33(19)32-21)18-10-12-28-22(31-18)30-17-4-1-3-15(13-17)23(25,26)27/h1-13H,(H,28,30,31)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8174
PNG
(N-(3,4-difluorophenyl)-4-[2-(4-fluorophenyl)pyrazo...)
Show SMILES Fc1ccc(cc1)-c1nn2ncccc2c1-c1ccnc(Nc2ccc(F)c(F)c2)n1
Show InChI InChI=1S/C22H13F3N6/c23-14-5-3-13(4-6-14)21-20(19-2-1-10-27-31(19)30-21)18-9-11-26-22(29-18)28-15-7-8-16(24)17(25)12-15/h1-12H,(H,26,28,29)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8175
PNG
(N-[4-chloro-3-(trifluoromethyl)phenyl]-4-[2-(4-flu...)
Show SMILES Fc1ccc(cc1)-c1nn2ncccc2c1-c1ccnc(Nc2ccc(Cl)c(c2)C(F)(F)F)n1
Show InChI InChI=1S/C23H13ClF4N6/c24-17-8-7-15(12-16(17)23(26,27)28)31-22-29-11-9-18(32-22)20-19-2-1-10-30-34(19)33-21(20)13-3-5-14(25)6-4-13/h1-12H,(H,29,31,32)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8176
PNG
(N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[2-(4-fluor...)
Show SMILES Fc1ccc(cc1)-c1nn2ncccc2c1-c1ccnc(Nc2ccc3OCCOc3c2)n1
Show InChI InChI=1S/C24H17FN6O2/c25-16-5-3-15(4-6-16)23-22(19-2-1-10-27-31(19)30-23)18-9-11-26-24(29-18)28-17-7-8-20-21(14-17)33-13-12-32-20/h1-11,14H,12-13H2,(H,26,28,29)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8177
PNG
(4-[2-(4-Methoxyphenyl)pyrazolo[1,5-b]pyridazin-3-y...)
Show SMILES COc1ccc(cc1)-c1nn2ncccc2c1-c1ccnc(Nc2ccccc2)n1
Show InChI InChI=1S/C23H18N6O/c1-30-18-11-9-16(10-12-18)22-21(20-8-5-14-25-29(20)28-22)19-13-15-24-23(27-19)26-17-6-3-2-4-7-17/h2-15H,1H3,(H,24,26,27)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8178
PNG
(4-[2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridazin-3-y...)
Show SMILES COc1ccc(cc1)-c1nn2ncccc2c1-c1ccnc(Nc2cccc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C24H17F3N6O/c1-34-18-9-7-15(8-10-18)22-21(20-6-3-12-29-33(20)32-22)19-11-13-28-23(31-19)30-17-5-2-4-16(14-17)24(25,26)27/h2-14H,1H3,(H,28,30,31)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8179
PNG
(N-(3,4-difluorophenyl)-4-[2-(4-methoxyphenyl)pyraz...)
Show SMILES COc1ccc(cc1)-c1nn2ncccc2c1-c1ccnc(Nc2ccc(F)c(F)c2)n1
Show InChI InChI=1S/C23H16F2N6O/c1-32-16-7-4-14(5-8-16)22-21(20-3-2-11-27-31(20)30-22)19-10-12-26-23(29-19)28-15-6-9-17(24)18(25)13-15/h2-13H,1H3,(H,26,28,29)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8180
PNG
(N-[4-chloro-3-(trifluoromethyl)phenyl]-4-[2-(4-met...)
Show SMILES COc1ccc(cc1)-c1nn2ncccc2c1-c1ccnc(Nc2ccc(Cl)c(c2)C(F)(F)F)n1
Show InChI InChI=1S/C24H16ClF3N6O/c1-35-16-7-4-14(5-8-16)22-21(20-3-2-11-30-34(20)33-22)19-10-12-29-23(32-19)31-15-6-9-18(25)17(13-15)24(26,27)28/h2-13H,1H3,(H,29,31,32)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8181
PNG
(N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[2-(4-metho...)
Show SMILES COc1ccc(cc1)-c1nn2ncccc2c1-c1ccnc(Nc2ccc3OCCOc3c2)n1
Show InChI InChI=1S/C25H20N6O3/c1-32-18-7-4-16(5-8-18)24-23(20-3-2-11-27-31(20)30-24)19-10-12-26-25(29-19)28-17-6-9-21-22(15-17)34-14-13-33-21/h2-12,15H,13-14H2,1H3,(H,26,28,29)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8182
PNG
(N-Phenyl-4-{2-[4-(trifluoromethyl)phenyl]pyrazolo-...)
Show SMILES FC(F)(F)c1ccc(cc1)-c1nn2ncccc2c1-c1ccnc(Nc2ccccc2)n1
Show InChI InChI=1S/C23H15F3N6/c24-23(25,26)16-10-8-15(9-11-16)21-20(19-7-4-13-28-32(19)31-21)18-12-14-27-22(30-18)29-17-5-2-1-3-6-17/h1-14H,(H,27,29,30)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8183
PNG
(N-[3-(trifluoromethyl)phenyl]-4-{2-[4-(trifluorome...)
Show SMILES FC(F)(F)c1ccc(cc1)-c1nn2ncccc2c1-c1ccnc(Nc2cccc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C24H14F6N6/c25-23(26,27)15-8-6-14(7-9-15)21-20(19-5-2-11-32-36(19)35-21)18-10-12-31-22(34-18)33-17-4-1-3-16(13-17)24(28,29)30/h1-13H,(H,31,33,34)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8184
PNG
(N-(3,4-difluorophenyl)-4-{2-[4-(trifluoromethyl)ph...)
Show SMILES Fc1ccc(Nc2nccc(n2)-c2c(nn3ncccc23)-c2ccc(cc2)C(F)(F)F)cc1F
Show InChI InChI=1S/C23H13F5N6/c24-16-8-7-15(12-17(16)25)31-22-29-11-9-18(32-22)20-19-2-1-10-30-34(19)33-21(20)13-3-5-14(6-4-13)23(26,27)28/h1-12H,(H,29,31,32)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8185
PNG
(N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{2-[4-(trif...)
Show SMILES FC(F)(F)c1ccc(cc1)-c1nn2ncccc2c1-c1ccnc(Nc2ccc3OCCOc3c2)n1
Show InChI InChI=1S/C25H17F3N6O2/c26-25(27,28)16-5-3-15(4-6-16)23-22(19-2-1-10-30-34(19)33-23)18-9-11-29-24(32-18)31-17-7-8-20-21(14-17)36-13-12-35-20/h1-11,14H,12-13H2,(H,29,31,32)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8186
PNG
(N-[4-chloro-3-(trifluoromethyl)phenyl]-4-{2-[4-(tr...)
Show SMILES FC(F)(F)c1ccc(cc1)-c1nn2ncccc2c1-c1ccnc(Nc2ccc(Cl)c(c2)C(F)(F)F)n1
Show InChI InChI=1S/C24H13ClF6N6/c25-17-8-7-15(12-16(17)24(29,30)31)34-22-32-11-9-18(35-22)20-19-2-1-10-33-37(19)36-21(20)13-3-5-14(6-4-13)23(26,27)28/h1-12H,(H,32,34,35)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8187
PNG
(N-Phenyl-4-{2-[3-(trifluoromethyl)phenyl]pyrazolo-...)
Show SMILES FC(F)(F)c1cccc(c1)-c1nn2ncccc2c1-c1ccnc(Nc2ccccc2)n1
Show InChI InChI=1S/C23H15F3N6/c24-23(25,26)16-7-4-6-15(14-16)21-20(19-10-5-12-28-32(19)31-21)18-11-13-27-22(30-18)29-17-8-2-1-3-9-17/h1-14H,(H,27,29,30)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (human))
BDBM8188
PNG
(N-(3,4-difluorophenyl)-4-{2-[3-(trifluoromethyl)ph...)
Show SMILES Fc1ccc(Nc2nccc(n2)-c2c(nn3ncccc23)-c2cccc(c2)C(F)(F)F)cc1F
Show InChI InChI=1S/C23H13F5N6/c24-16-7-6-15(12-17(16)25)31-22-29-10-8-18(32-22)20-19-5-2-9-30-34(19)33-21(20)13-3-1-4-14(11-13)23(26,27)28/h1-12H,(H,29,31,32)
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n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


J Med Chem 47: 4716-30 (2004)


Article DOI: 10.1021/jm040063i
BindingDB Entry DOI: 10.7270/Q2VM49HJ
More data for this
Ligand-Target Pair
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