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Compile Data Set for Download or QSAR

Found 34 hits from Daiichi Sankyo Co. Ltd   
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 4 (CDK4)


(Homo sapiens (Human))
BDBM50481296
PNG
(CHEMBL608995)
Show SMILES CC(C)(C)c1cc2c(N\N=C\c3ccc(CN)cc3)ncnc2s1
Show InChI InChI=1S/C18H21N5S/c1-18(2,3)15-8-14-16(20-11-21-17(14)24-15)23-22-10-13-6-4-12(9-19)5-7-13/h4-8,10-11H,9,19H2,1-3H3,(H,20,21,23)/b22-10+
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n/an/a 61.9n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM50481281
PNG
(CHEMBL595023)
Show SMILES CN(CCO)Cc1ccc(\C=N\Nc2ncnc3sc(cc23)C(C)(C)C)cc1
Show InChI InChI=1S/C21H27N5OS/c1-21(2,3)18-11-17-19(22-14-23-20(17)28-18)25-24-12-15-5-7-16(8-6-15)13-26(4)9-10-27/h5-8,11-12,14,27H,9-10,13H2,1-4H3,(H,22,23,25)/b24-12+
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n/an/a 70.4n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM50481285
PNG
(CHEMBL611012)
Show SMILES CN(C)Cc1cccc(\C=N\Nc2ncnc3sc(cc23)C(C)(C)C)c1
Show InChI InChI=1S/C20H25N5S/c1-20(2,3)17-10-16-18(21-13-22-19(16)26-17)24-23-11-14-7-6-8-15(9-14)12-25(4)5/h6-11,13H,12H2,1-5H3,(H,21,22,24)/b23-11+
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n/an/a 70.7n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM50481292
PNG
(CHEMBL593444)
Show SMILES CC(C)(C)c1cc2c(N\N=C\c3ccc4CCNCc4c3)ncnc2s1
Show InChI InChI=1S/C20H23N5S/c1-20(2,3)17-9-16-18(22-12-23-19(16)26-17)25-24-10-13-4-5-14-6-7-21-11-15(14)8-13/h4-5,8-10,12,21H,6-7,11H2,1-3H3,(H,22,23,25)/b24-10+
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n/an/a 93n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM50481284
PNG
(CHEMBL594349)
Show SMILES CC(C)(C)c1cc2c(N\N=C\c3ccc4CNCCc4c3)ncnc2s1
Show InChI InChI=1S/C20H23N5S/c1-20(2,3)17-9-16-18(22-12-23-19(16)26-17)25-24-10-13-4-5-15-11-21-7-6-14(15)8-13/h4-5,8-10,12,21H,6-7,11H2,1-3H3,(H,22,23,25)/b24-10+
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n/an/a 103n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM50481294
PNG
(CHEMBL595726)
Show SMILES CNCc1ccc(\C=N\Nc2ncnc3sc(cc23)C(C)(C)C)cc1
Show InChI InChI=1S/C19H23N5S/c1-19(2,3)16-9-15-17(21-12-22-18(15)25-16)24-23-11-14-7-5-13(6-8-14)10-20-4/h5-9,11-12,20H,10H2,1-4H3,(H,21,22,24)/b23-11+
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n/an/a 107n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM50481286
PNG
(CHEMBL596174)
Show SMILES CN(C)Cc1cccc(\C=N\Nc2ncnc3sc(cc23)C(C)(C)C)n1
Show InChI InChI=1S/C19H24N6S/c1-19(2,3)16-9-15-17(20-12-21-18(15)26-16)24-22-10-13-7-6-8-14(23-13)11-25(4)5/h6-10,12H,11H2,1-5H3,(H,20,21,24)/b22-10+
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n/an/a 151n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM50481287
PNG
(CHEMBL603199)
Show SMILES CC(C)N1Cc2ccc(\C=N\Nc3ncnc4sc(cc34)C(C)(C)C)cc2C1
Show InChI InChI=1S/C22H27N5S/c1-14(2)27-11-16-7-6-15(8-17(16)12-27)10-25-26-20-18-9-19(22(3,4)5)28-21(18)24-13-23-20/h6-10,13-14H,11-12H2,1-5H3,(H,23,24,26)/b25-10+
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n/an/a 203n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM50481290
PNG
(CHEMBL610461)
Show SMILES CN(C)Cc1ccc(\C=N\Nc2ncnc3sc(cc23)C(C)(C)C)cc1
Show InChI InChI=1S/C20H25N5S/c1-20(2,3)17-10-16-18(21-13-22-19(16)26-17)24-23-11-14-6-8-15(9-7-14)12-25(4)5/h6-11,13H,12H2,1-5H3,(H,21,22,24)/b23-11+
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n/an/a 209n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM50481283
PNG
(CHEMBL593397)
Show SMILES CC(C)(C)c1cc2c(N\N=C\c3ccc4CNCc4c3)ncnc2s1
Show InChI InChI=1S/C19H21N5S/c1-19(2,3)16-7-15-17(21-11-22-18(15)25-16)24-23-8-12-4-5-13-9-20-10-14(13)6-12/h4-8,11,20H,9-10H2,1-3H3,(H,21,22,24)/b23-8+
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n/an/a 236n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM50481293
PNG
(CHEMBL594340)
Show SMILES CN1Cc2ccc(\C=N\Nc3ncnc4sc(cc34)C(C)(C)C)cc2C1
Show InChI InChI=1S/C20H23N5S/c1-20(2,3)17-8-16-18(21-12-22-19(16)26-17)24-23-9-13-5-6-14-10-25(4)11-15(14)7-13/h5-9,12H,10-11H2,1-4H3,(H,21,22,24)/b23-9+
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n/an/a 262n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481292
PNG
(CHEMBL593444)
Show SMILES CC(C)(C)c1cc2c(N\N=C\c3ccc4CCNCc4c3)ncnc2s1
Show InChI InChI=1S/C20H23N5S/c1-20(2,3)17-9-16-18(22-12-23-19(16)26-17)25-24-10-13-4-5-14-6-7-21-11-15(14)8-13/h4-5,8-10,12,21H,6-7,11H2,1-3H3,(H,22,23,25)/b24-10+
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n/an/a 492n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481281
PNG
(CHEMBL595023)
Show SMILES CN(CCO)Cc1ccc(\C=N\Nc2ncnc3sc(cc23)C(C)(C)C)cc1
Show InChI InChI=1S/C21H27N5OS/c1-21(2,3)18-11-17-19(22-14-23-20(17)28-18)25-24-12-15-5-7-16(8-6-15)13-26(4)9-10-27/h5-8,11-12,14,27H,9-10,13H2,1-4H3,(H,22,23,25)/b24-12+
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n/an/a 729n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481280
PNG
(CHEMBL607544)
Show SMILES CC(C)(C)c1cc2c(N\N=C\c3ccc(CO)cc3)ncnc2s1
Show InChI InChI=1S/C18H20N4OS/c1-18(2,3)15-8-14-16(19-11-20-17(14)24-15)22-21-9-12-4-6-13(10-23)7-5-12/h4-9,11,23H,10H2,1-3H3,(H,19,20,22)/b21-9+
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n/an/a 763n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481282
PNG
(CHEMBL593683)
Show SMILES CC(C)(C)c1cc2c(N\N=C\c3ccc(cc3)C(O)=O)ncnc2s1
Show InChI InChI=1S/C18H18N4O2S/c1-18(2,3)14-8-13-15(19-10-20-16(13)25-14)22-21-9-11-4-6-12(7-5-11)17(23)24/h4-10H,1-3H3,(H,23,24)(H,19,20,22)/b21-9+
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n/an/a 1.10E+3n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM50481280
PNG
(CHEMBL607544)
Show SMILES CC(C)(C)c1cc2c(N\N=C\c3ccc(CO)cc3)ncnc2s1
Show InChI InChI=1S/C18H20N4OS/c1-18(2,3)15-8-14-16(19-11-20-17(14)24-15)22-21-9-12-4-6-13(10-23)7-5-12/h4-9,11,23H,10H2,1-3H3,(H,19,20,22)/b21-9+
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n/an/a 1.17E+3n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481283
PNG
(CHEMBL593397)
Show SMILES CC(C)(C)c1cc2c(N\N=C\c3ccc4CNCc4c3)ncnc2s1
Show InChI InChI=1S/C19H21N5S/c1-19(2,3)16-7-15-17(21-11-22-18(15)25-16)24-23-8-12-4-5-13-9-20-10-14(13)6-12/h4-8,11,20H,9-10H2,1-3H3,(H,21,22,24)/b23-8+
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n/an/a 1.47E+3n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481290
PNG
(CHEMBL610461)
Show SMILES CN(C)Cc1ccc(\C=N\Nc2ncnc3sc(cc23)C(C)(C)C)cc1
Show InChI InChI=1S/C20H25N5S/c1-20(2,3)17-10-16-18(21-13-22-19(16)26-17)24-23-11-14-6-8-15(9-7-14)12-25(4)5/h6-11,13H,12H2,1-5H3,(H,21,22,24)/b23-11+
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n/an/a 1.63E+3n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481284
PNG
(CHEMBL594349)
Show SMILES CC(C)(C)c1cc2c(N\N=C\c3ccc4CNCCc4c3)ncnc2s1
Show InChI InChI=1S/C20H23N5S/c1-20(2,3)17-9-16-18(22-12-23-19(16)26-17)25-24-10-13-4-5-15-11-21-7-6-14(15)8-13/h4-5,8-10,12,21H,6-7,11H2,1-3H3,(H,22,23,25)/b24-10+
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n/an/a 1.75E+3n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481294
PNG
(CHEMBL595726)
Show SMILES CNCc1ccc(\C=N\Nc2ncnc3sc(cc23)C(C)(C)C)cc1
Show InChI InChI=1S/C19H23N5S/c1-19(2,3)16-9-15-17(21-12-22-18(15)25-16)24-23-11-14-7-5-13(6-8-14)10-20-4/h5-9,11-12,20H,10H2,1-4H3,(H,21,22,24)/b23-11+
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n/an/a 1.92E+3n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM50481295
PNG
(CHEMBL606635)
Show SMILES CC(C)(C)c1cc2c(N\N=C\c3ccccc3)ncnc2s1
Show InChI InChI=1S/C17H18N4S/c1-17(2,3)14-9-13-15(18-11-19-16(13)22-14)21-20-10-12-7-5-4-6-8-12/h4-11H,1-3H3,(H,18,19,21)/b20-10+
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n/an/a 1.96E+3n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481293
PNG
(CHEMBL594340)
Show SMILES CN1Cc2ccc(\C=N\Nc3ncnc4sc(cc34)C(C)(C)C)cc2C1
Show InChI InChI=1S/C20H23N5S/c1-20(2,3)17-8-16-18(21-12-22-19(16)26-17)24-23-9-13-5-6-14-10-25(4)11-15(14)7-13/h5-9,12H,10-11H2,1-4H3,(H,21,22,24)/b23-9+
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n/an/a 2.73E+3n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM50481282
PNG
(CHEMBL593683)
Show SMILES CC(C)(C)c1cc2c(N\N=C\c3ccc(cc3)C(O)=O)ncnc2s1
Show InChI InChI=1S/C18H18N4O2S/c1-18(2,3)14-8-13-15(19-10-20-16(13)25-14)22-21-9-11-4-6-12(7-5-11)17(23)24/h4-10H,1-3H3,(H,23,24)(H,19,20,22)/b21-9+
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n/an/a 2.76E+3n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481291
PNG
(CHEMBL592946)
Show SMILES CN(C)S(=O)(=O)c1ccc(\C=N\Nc2ncnc3sc(cc23)C(C)(C)C)cc1
Show InChI InChI=1S/C19H23N5O2S2/c1-19(2,3)16-10-15-17(20-12-21-18(15)27-16)23-22-11-13-6-8-14(9-7-13)28(25,26)24(4)5/h6-12H,1-5H3,(H,20,21,23)/b22-11+
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n/an/a 2.87E+3n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481285
PNG
(CHEMBL611012)
Show SMILES CN(C)Cc1cccc(\C=N\Nc2ncnc3sc(cc23)C(C)(C)C)c1
Show InChI InChI=1S/C20H25N5S/c1-20(2,3)17-10-16-18(21-13-22-19(16)26-17)24-23-11-14-7-6-8-15(9-14)12-25(4)5/h6-11,13H,12H2,1-5H3,(H,21,22,24)/b23-11+
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n/an/a 2.99E+3n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481286
PNG
(CHEMBL596174)
Show SMILES CN(C)Cc1cccc(\C=N\Nc2ncnc3sc(cc23)C(C)(C)C)n1
Show InChI InChI=1S/C19H24N6S/c1-19(2,3)16-9-15-17(20-12-21-18(15)26-16)24-22-10-13-7-6-8-14(23-13)11-25(4)5/h6-10,12H,11H2,1-5H3,(H,20,21,24)/b22-10+
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n/an/a 3.79E+3n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481296
PNG
(CHEMBL608995)
Show SMILES CC(C)(C)c1cc2c(N\N=C\c3ccc(CN)cc3)ncnc2s1
Show InChI InChI=1S/C18H21N5S/c1-18(2,3)15-8-14-16(20-11-21-17(14)24-15)23-22-10-13-6-4-12(9-19)5-7-13/h4-8,10-11H,9,19H2,1-3H3,(H,20,21,23)/b22-10+
PDB

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n/an/a 4.71E+3n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481287
PNG
(CHEMBL603199)
Show SMILES CC(C)N1Cc2ccc(\C=N\Nc3ncnc4sc(cc34)C(C)(C)C)cc2C1
Show InChI InChI=1S/C22H27N5S/c1-14(2)27-11-16-7-6-15(8-17(16)12-27)10-25-26-20-18-9-19(22(3,4)5)28-21(18)24-13-23-20/h6-10,13-14H,11-12H2,1-5H3,(H,23,24,26)/b25-10+
PDB

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n/an/a 7.62E+3n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481289
PNG
(CHEMBL595510)
Show SMILES CC(C)(C)c1cc2c(N\N=C\c3ccc(O)cc3)ncnc2s1
Show InChI InChI=1S/C17H18N4OS/c1-17(2,3)14-8-13-15(18-10-19-16(13)23-14)21-20-9-11-4-6-12(22)7-5-11/h4-10,22H,1-3H3,(H,18,19,21)/b20-9+
PDB

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n/an/a 3.36E+4n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM50481291
PNG
(CHEMBL592946)
Show SMILES CN(C)S(=O)(=O)c1ccc(\C=N\Nc2ncnc3sc(cc23)C(C)(C)C)cc1
Show InChI InChI=1S/C19H23N5O2S2/c1-19(2,3)16-10-15-17(20-12-21-18(15)27-16)23-22-11-13-6-8-14(9-7-13)28(25,26)24(4)5/h6-12H,1-5H3,(H,20,21,23)/b22-11+
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n/an/a>4.78E+4n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM50481288
PNG
(CHEMBL609889)
Show SMILES COC(=O)c1ccc(\C=N\Nc2ncnc3sc(cc23)C(C)(C)C)cc1
Show InChI InChI=1S/C19H20N4O2S/c1-19(2,3)15-9-14-16(20-11-21-17(14)26-15)23-22-10-12-5-7-13(8-6-12)18(24)25-4/h5-11H,1-4H3,(H,20,21,23)/b22-10+
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n/an/a>5.42E+4n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481288
PNG
(CHEMBL609889)
Show SMILES COC(=O)c1ccc(\C=N\Nc2ncnc3sc(cc23)C(C)(C)C)cc1
Show InChI InChI=1S/C19H20N4O2S/c1-19(2,3)15-9-14-16(20-11-21-17(14)26-15)23-22-10-12-5-7-13(8-6-12)18(24)25-4/h5-11H,1-4H3,(H,20,21,23)/b22-10+
PDB

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n/an/a>5.42E+4n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM50481289
PNG
(CHEMBL595510)
Show SMILES CC(C)(C)c1cc2c(N\N=C\c3ccc(O)cc3)ncnc2s1
Show InChI InChI=1S/C17H18N4OS/c1-17(2,3)14-8-13-15(18-10-19-16(13)23-14)21-20-9-11-4-6-12(22)7-5-11/h4-10,22H,1-3H3,(H,18,19,21)/b20-9+
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n/an/a>6.12E+4n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK4/Cyclin D1 expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM50481295
PNG
(CHEMBL606635)
Show SMILES CC(C)(C)c1cc2c(N\N=C\c3ccccc3)ncnc2s1
Show InChI InChI=1S/C17H18N4S/c1-17(2,3)14-9-13-15(18-11-19-16(13)22-14)21-20-10-12-7-5-4-6-8-12/h4-11H,1-3H3,(H,18,19,21)/b20-10+
PDB

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n/an/a>6.44E+4n/an/an/an/an/an/a



Daiichi Sankyo Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of CDK2/Cyclin E expressed in Sf9 cells assessed as inhibition of Rb phosphorylation


Bioorg Med Chem 17: 7850-60 (2009)

More data for this
Ligand-Target Pair