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PubMed code 11101352

Compile data set for download or QSAR
Found 88 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6266
PNG
(8-Cyclopentyl-2-[4-(2-diethylaminoethoxy)phenylami...)
Show SMILES CCN(CC)CCOc1ccc(Nc2ncc3ccc(=O)n(C4CCCC4)c3n2)cc1
Show InChI InChI=1S/C24H31N5O2/c1-3-28(4-2)15-16-31-21-12-10-19(11-13-21)26-24-25-17-18-9-14-22(30)29(23(18)27-24)20-7-5-6-8-20/h9-14,17,20H,3-8,15-16H2,1-2H3,(H,25,26,27)
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n/an/a 0.700n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6278
PNG
(8-Cyclohexyl-2-[4-(4-methylpiperazin-1-yl)phenylam...)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(C4CCCCC4)c3n2)cc1
Show InChI InChI=1S/C24H30N6O/c1-28-13-15-29(16-14-28)20-10-8-19(9-11-20)26-24-25-17-18-7-12-22(31)30(23(18)27-24)21-5-3-2-4-6-21/h7-12,17,21H,2-6,13-16H2,1H3,(H,25,26,27)
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n/an/a 4n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6268
PNG
(8-Cycloheptyl-2-[4-(2-diethylaminoethoxy)phenylami...)
Show SMILES CCN(CC)CCOc1ccc(Nc2ncc3ccc(=O)n(C4CCCCCC4)c3n2)cc1
Show InChI InChI=1S/C26H35N5O2/c1-3-30(4-2)17-18-33-23-14-12-21(13-15-23)28-26-27-19-20-11-16-24(32)31(25(20)29-26)22-9-7-5-6-8-10-22/h11-16,19,22H,3-10,17-18H2,1-2H3,(H,27,28,29)
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n/an/a 4n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6277
PNG
(8-Bicyclo[2.2.1]hept-2-yl-2-[4-(4-methylpiperazin-...)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(C4CC5CCC4C5)c3n2)cc1 |THB:20:21:24.25:27|
Show InChI InChI=1S/C25H30N6O/c1-29-10-12-30(13-11-29)21-7-5-20(6-8-21)27-25-26-16-19-4-9-23(32)31(24(19)28-25)22-15-17-2-3-18(22)14-17/h4-9,16-18,22H,2-3,10-15H2,1H3,(H,26,27,28)
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n/an/a 6n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6280
PNG
(8-Bicyclo[2.2.1]hept-2-yl-2-{4-[4-(3-hydroxypropyl...)
Show SMILES OCCCC1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(C4CC5CCC4C5)c3n2)cc1 |THB:23:24:27.28:30|
Show InChI InChI=1S/C28H35N5O2/c34-15-1-2-19-11-13-32(14-12-19)24-8-6-23(7-9-24)30-28-29-18-22-5-10-26(35)33(27(22)31-28)25-17-20-3-4-21(25)16-20/h5-10,18-21,25,34H,1-4,11-17H2,(H,29,30,31)
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n/an/a 8n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6276
PNG
(8-Cyclopentyl-2-[4-(4-methylpiperazin-1-yl)phenyla...)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(C4CCCC4)c3n2)cc1
Show InChI InChI=1S/C23H28N6O/c1-27-12-14-28(15-13-27)19-9-7-18(8-10-19)25-23-24-16-17-6-11-21(30)29(22(17)26-23)20-4-2-3-5-20/h6-11,16,20H,2-5,12-15H2,1H3,(H,24,25,26)
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Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6267
PNG
(8-Cyclohexyl-2-[4-(2-diethylaminoethoxy)phenylamin...)
Show SMILES CCN(CC)CCOc1ccc(Nc2ncc3ccc(=O)n(C4CCCCC4)c3n2)cc1
Show InChI InChI=1S/C25H33N5O2/c1-3-29(4-2)16-17-32-22-13-11-20(12-14-22)27-25-26-18-19-10-15-23(31)30(24(19)28-25)21-8-6-5-7-9-21/h10-15,18,21H,3-9,16-17H2,1-2H3,(H,26,27,28)
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Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6275
PNG
(8-(3-methylbutyl)-2-{[4-(4-methylpiperazin-1-yl)ph...)
Show SMILES CC(C)CCn1c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2ccc1=O
Show InChI InChI=1S/C23H30N6O/c1-17(2)10-11-29-21(30)9-4-18-16-24-23(26-22(18)29)25-19-5-7-20(8-6-19)28-14-12-27(3)13-15-28/h4-9,16-17H,10-15H2,1-3H3,(H,24,25,26)
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Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (Human))
BDBM6278
PNG
(8-Cyclohexyl-2-[4-(4-methylpiperazin-1-yl)phenylam...)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(C4CCCCC4)c3n2)cc1
Show InChI InChI=1S/C24H30N6O/c1-28-13-15-29(16-14-28)20-10-8-19(9-11-20)26-24-25-17-18-7-12-22(31)30(23(18)27-24)21-5-3-2-4-6-21/h7-12,17,21H,2-6,13-16H2,1H3,(H,25,26,27)
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n/an/a 15n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM6278
PNG
(8-Cyclohexyl-2-[4-(4-methylpiperazin-1-yl)phenylam...)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(C4CCCCC4)c3n2)cc1
Show InChI InChI=1S/C24H30N6O/c1-28-13-15-29(16-14-28)20-10-8-19(9-11-20)26-24-25-17-18-7-12-22(31)30(23(18)27-24)21-5-3-2-4-6-21/h7-12,17,21H,2-6,13-16H2,1H3,(H,25,26,27)
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n/an/a 20n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6274
PNG
(2-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-8-(pro...)
Show SMILES CC(C)n1c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2ccc1=O
Show InChI InChI=1S/C21H26N6O/c1-15(2)27-19(28)9-4-16-14-22-21(24-20(16)27)23-17-5-7-18(8-6-17)26-12-10-25(3)11-13-26/h4-9,14-15H,10-13H2,1-3H3,(H,22,23,24)
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Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6279
PNG
(8-Cyclopentyl-2-{4-[4-(3-hydroxypropyl)piperidin-1...)
Show SMILES OCCCC1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(C4CCCC4)c3n2)cc1
Show InChI InChI=1S/C26H33N5O2/c32-17-3-4-19-13-15-30(16-14-19)22-10-8-21(9-11-22)28-26-27-18-20-7-12-24(33)31(25(20)29-26)23-5-1-2-6-23/h7-12,18-19,23,32H,1-6,13-17H2,(H,27,28,29)
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Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (Human))
BDBM6250
PNG
(8-Butyl-2-phenylamino-8H-pyrido[2,3-d]pyrimidin-7-...)
Show SMILES CCCCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C17H18N4O/c1-2-3-11-21-15(22)10-9-13-12-18-17(20-16(13)21)19-14-7-5-4-6-8-14/h4-10,12H,2-3,11H2,1H3,(H,18,19,20)
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n/an/a 37n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6256
PNG
(8-Bicyclo[2.2.1]hept-2-yl-2-phenylamino-8H-pyrido[...)
Show SMILES O=c1ccc2cnc(Nc3ccccc3)nc2n1C1CC2CCC1C2 |THB:17:18:21.22:24|
Show InChI InChI=1S/C20H20N4O/c25-18-9-8-15-12-21-20(22-16-4-2-1-3-5-16)23-19(15)24(18)17-11-13-6-7-14(17)10-13/h1-5,8-9,12-14,17H,6-7,10-11H2,(H,21,22,23)
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Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6265
PNG
(2-({4-[2-(diethylamino)ethoxy]phenyl}amino)-8-(pro...)
Show SMILES CCN(CC)CCOc1ccc(Nc2ncc3ccc(=O)n(C(C)C)c3n2)cc1
Show InChI InChI=1S/C22H29N5O2/c1-5-26(6-2)13-14-29-19-10-8-18(9-11-19)24-22-23-15-17-7-12-20(28)27(16(3)4)21(17)25-22/h7-12,15-16H,5-6,13-14H2,1-4H3,(H,23,24,25)
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Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6254
PNG
(8-Cyclohexyl-2-phenylamino-8H-pyrido[2,3-d]pyrimid...)
Show SMILES O=c1ccc2cnc(Nc3ccccc3)nc2n1C1CCCCC1
Show InChI InChI=1S/C19H20N4O/c24-17-12-11-14-13-20-19(21-15-7-3-1-4-8-15)22-18(14)23(17)16-9-5-2-6-10-16/h1,3-4,7-8,11-13,16H,2,5-6,9-10H2,(H,20,21,22)
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Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (Human))
BDBM6248
PNG
(2-(phenylamino)-8-propyl-7H,8H-pyrido[2,3-d]pyrimi...)
Show SMILES CCCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C16H16N4O/c1-2-10-20-14(21)9-8-12-11-17-16(19-15(12)20)18-13-6-4-3-5-7-13/h3-9,11H,2,10H2,1H3,(H,17,18,19)
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n/an/a 50n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM6278
PNG
(8-Cyclohexyl-2-[4-(4-methylpiperazin-1-yl)phenylam...)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(C4CCCCC4)c3n2)cc1
Show InChI InChI=1S/C24H30N6O/c1-28-13-15-29(16-14-28)20-10-8-19(9-11-20)26-24-25-17-18-7-12-22(31)30(23(18)27-24)21-5-3-2-4-6-21/h7-12,17,21H,2-6,13-16H2,1H3,(H,25,26,27)
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Parke-Davis Pharmaceutical Research



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM6250
PNG
(8-Butyl-2-phenylamino-8H-pyrido[2,3-d]pyrimidin-7-...)
Show SMILES CCCCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C17H18N4O/c1-2-3-11-21-15(22)10-9-13-12-18-17(20-16(13)21)19-14-7-5-4-6-8-14/h4-10,12H,2-3,11H2,1H3,(H,18,19,20)
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n/an/a 58n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (Human))
BDBM6274
PNG
(2-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-8-(pro...)
Show SMILES CC(C)n1c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2ccc1=O
Show InChI InChI=1S/C21H26N6O/c1-15(2)27-19(28)9-4-16-14-22-21(24-20(16)27)23-17-5-7-18(8-6-17)26-12-10-25(3)11-13-26/h4-9,14-15H,10-13H2,1-3H3,(H,22,23,24)
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n/an/a 58n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM6274
PNG
(2-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-8-(pro...)
Show SMILES CC(C)n1c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2ccc1=O
Show InChI InChI=1S/C21H26N6O/c1-15(2)27-19(28)9-4-16-14-22-21(24-20(16)27)23-17-5-7-18(8-6-17)26-12-10-25(3)11-13-26/h4-9,14-15H,10-13H2,1-3H3,(H,22,23,24)
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n/an/a 70n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 1 (CDK1)


(Homo sapiens (Human))
BDBM6278
PNG
(8-Cyclohexyl-2-[4-(4-methylpiperazin-1-yl)phenylam...)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(C4CCCCC4)c3n2)cc1
Show InChI InChI=1S/C24H30N6O/c1-28-13-15-29(16-14-28)20-10-8-19(9-11-20)26-24-25-17-18-7-12-22(31)30(23(18)27-24)21-5-3-2-4-6-21/h7-12,17,21H,2-6,13-16H2,1H3,(H,25,26,27)
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n/an/a 79n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6245
PNG
(8-Ethyl-2-[4-(4-methylpiperazin-1-yl)phenylamino]-...)
Show SMILES CCn1c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2ccc1=O
Show InChI InChI=1S/C20H24N6O/c1-3-26-18(27)9-4-15-14-21-20(23-19(15)26)22-16-5-7-17(8-6-16)25-12-10-24(2)11-13-25/h4-9,14H,3,10-13H2,1-2H3,(H,21,22,23)
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n/an/a 85n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 1 (CDK1)


(Homo sapiens (Human))
BDBM6231
PNG
(8-Ethyl-2-[3-(1,1,2,2-tetrafluoroethoxy)phenylamin...)
Show SMILES CCn1c2nc(Nc3cccc(OC(F)(F)C(F)F)c3)ncc2ccc1=O
Show InChI InChI=1S/C17H14F4N4O2/c1-2-25-13(26)7-6-10-9-22-16(24-14(10)25)23-11-4-3-5-12(8-11)27-17(20,21)15(18)19/h3-9,15H,2H2,1H3,(H,22,23,24)
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n/an/a 91n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM6248
PNG
(2-(phenylamino)-8-propyl-7H,8H-pyrido[2,3-d]pyrimi...)
Show SMILES CCCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C16H16N4O/c1-2-10-20-14(21)9-8-12-11-17-16(19-15(12)20)18-13-6-4-3-5-7-13/h3-9,11H,2,10H2,1H3,(H,17,18,19)
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n/an/a 112n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (Human))
BDBM6221
PNG
(8-Ethyl-2-phenylamino-8H-pyrido[2,3-d]pyrimidin-7-...)
Show SMILES CCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C15H14N4O/c1-2-19-13(20)9-8-11-10-16-15(18-14(11)19)17-12-6-4-3-5-7-12/h3-10H,2H2,1H3,(H,16,17,18)
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n/an/a 129n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6273
PNG
(8-Cyclopropyl-2-[4-(4-methylpiperazin-1-yl)phenyla...)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(C4CC4)c3n2)cc1
Show InChI InChI=1S/C21H24N6O/c1-25-10-12-26(13-11-25)17-5-3-16(4-6-17)23-21-22-14-15-2-9-19(28)27(18-7-8-18)20(15)24-21/h2-6,9,14,18H,7-8,10-13H2,1H3,(H,22,23,24)
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n/an/a 140n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6247
PNG
(2-(phenylamino)-8-(propan-2-yl)-7H,8H-pyrido[2,3-d...)
Show SMILES CC(C)n1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C16H16N4O/c1-11(2)20-14(21)9-8-12-10-17-16(19-15(12)20)18-13-6-4-3-5-7-13/h3-11H,1-2H3,(H,17,18,19)
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n/an/a 145n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6252
PNG
(8-(3-methylbutyl)-2-(phenylamino)-7H,8H-pyrido[2,3...)
Show SMILES CC(C)CCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C18H20N4O/c1-13(2)10-11-22-16(23)9-8-14-12-19-18(21-17(14)22)20-15-6-4-3-5-7-15/h3-9,12-13H,10-11H2,1-2H3,(H,19,20,21)
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n/an/a 159n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6238
PNG
(2-({4-[2-(diethylamino)ethoxy]phenyl}amino)-8-ethy...)
Show SMILES CCN(CC)CCOc1ccc(Nc2ncc3ccc(=O)n(CC)c3n2)cc1
Show InChI InChI=1S/C21H27N5O2/c1-4-25(5-2)13-14-28-18-10-8-17(9-11-18)23-21-22-15-16-7-12-19(27)26(6-3)20(16)24-21/h7-12,15H,4-6,13-14H2,1-3H3,(H,22,23,24)
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n/an/a 160n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM6280
PNG
(8-Bicyclo[2.2.1]hept-2-yl-2-{4-[4-(3-hydroxypropyl...)
Show SMILES OCCCC1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(C4CC5CCC4C5)c3n2)cc1 |THB:23:24:27.28:30|
Show InChI InChI=1S/C28H35N5O2/c34-15-1-2-19-11-13-32(14-12-19)24-8-6-23(7-9-24)30-28-29-18-22-5-10-26(35)33(27(22)31-28)25-17-20-3-4-21(25)16-20/h5-10,18-21,25,34H,1-4,11-17H2,(H,29,30,31)
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n/an/a 165n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6272
PNG
(2-[4-(4-Methylpiperazin-1-yl)phenylamino]-8-phenyl...)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(-c4ccccc4)c3n2)cc1
Show InChI InChI=1S/C24H24N6O/c1-28-13-15-29(16-14-28)20-10-8-19(9-11-20)26-24-25-17-18-7-12-22(31)30(23(18)27-24)21-5-3-2-4-6-21/h2-12,17H,13-16H2,1H3,(H,25,26,27)
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n/an/a 175n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6255
PNG
(8-Cycloheptyl-2-phenylamino-8H-pyrido[2,3-d]pyrimi...)
Show SMILES O=c1ccc2cnc(Nc3ccccc3)nc2n1C1CCCCCC1
Show InChI InChI=1S/C20H22N4O/c25-18-13-12-15-14-21-20(22-16-8-4-3-5-9-16)23-19(15)24(18)17-10-6-1-2-7-11-17/h3-5,8-9,12-14,17H,1-2,6-7,10-11H2,(H,21,22,23)
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n/an/a 182n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6249
PNG
(8-(butan-2-yl)-2-(phenylamino)-7H,8H-pyrido[2,3-d]...)
Show SMILES CCC(C)n1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C17H18N4O/c1-3-12(2)21-15(22)10-9-13-11-18-17(20-16(13)21)19-14-7-5-4-6-8-14/h4-12H,3H2,1-2H3,(H,18,19,20)
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n/an/a 190n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (Human))
BDBM6280
PNG
(8-Bicyclo[2.2.1]hept-2-yl-2-{4-[4-(3-hydroxypropyl...)
Show SMILES OCCCC1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(C4CC5CCC4C5)c3n2)cc1 |THB:23:24:27.28:30|
Show InChI InChI=1S/C28H35N5O2/c34-15-1-2-19-11-13-32(14-12-19)24-8-6-23(7-9-24)30-28-29-18-22-5-10-26(35)33(27(22)31-28)25-17-20-3-4-21(25)16-20/h5-10,18-21,25,34H,1-4,11-17H2,(H,29,30,31)
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n/an/a 209n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6253
PNG
(8-Cyclopentyl-2-phenylamino-8H-pyrido[2,3-d]pyrimi...)
Show SMILES O=c1ccc2cnc(Nc3ccccc3)nc2n1C1CCCC1
Show InChI InChI=1S/C18H18N4O/c23-16-11-10-13-12-19-18(20-14-6-2-1-3-7-14)21-17(13)22(16)15-8-4-5-9-15/h1-3,6-7,10-12,15H,4-5,8-9H2,(H,19,20,21)
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n/an/a 210n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (Human))
BDBM6231
PNG
(8-Ethyl-2-[3-(1,1,2,2-tetrafluoroethoxy)phenylamin...)
Show SMILES CCn1c2nc(Nc3cccc(OC(F)(F)C(F)F)c3)ncc2ccc1=O
Show InChI InChI=1S/C17H14F4N4O2/c1-2-25-13(26)7-6-10-9-22-16(24-14(10)25)23-11-4-3-5-12(8-11)27-17(20,21)15(18)19/h3-9,15H,2H2,1H3,(H,22,23,24)
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Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM6274
PNG
(2-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-8-(pro...)
Show SMILES CC(C)n1c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2ccc1=O
Show InChI InChI=1S/C21H26N6O/c1-15(2)27-19(28)9-4-16-14-22-21(24-20(16)27)23-17-5-7-18(8-6-17)26-12-10-25(3)11-13-26/h4-9,14-15H,10-13H2,1-3H3,(H,22,23,24)
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n/an/a 270n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6251
PNG
(8-(2-methylpropyl)-2-(phenylamino)-7H,8H-pyrido[2,...)
Show SMILES CC(C)Cn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C17H18N4O/c1-12(2)11-21-15(22)9-8-13-10-18-17(20-16(13)21)19-14-6-4-3-5-7-14/h3-10,12H,11H2,1-2H3,(H,18,19,20)
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n/an/a 297n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 1 (CDK1)


(Homo sapiens (Human))
BDBM6248
PNG
(2-(phenylamino)-8-propyl-7H,8H-pyrido[2,3-d]pyrimi...)
Show SMILES CCCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C16H16N4O/c1-2-10-20-14(21)9-8-12-11-17-16(19-15(12)20)18-13-6-4-3-5-7-13/h3-9,11H,2,10H2,1H3,(H,17,18,19)
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n/an/a 299n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6242
PNG
(8-Ethyl-2-(4-(morpholin-4-yl)phenylamino)-8H-pyrid...)
Show SMILES CCn1c2nc(Nc3ccc(cc3)N3CCOCC3)ncc2ccc1=O
Show InChI InChI=1S/C19H21N5O2/c1-2-24-17(25)8-3-14-13-20-19(22-18(14)24)21-15-4-6-16(7-5-15)23-9-11-26-12-10-23/h3-8,13H,2,9-12H2,1H3,(H,20,21,22)
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Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6243
PNG
(8-Ethyl-2-(4-piperidin-1-ylphenylamino)-8H-pyrido[...)
Show SMILES CCn1c2nc(Nc3ccc(cc3)N3CCCCC3)ncc2ccc1=O
Show InChI InChI=1S/C20H23N5O/c1-2-25-18(26)11-6-15-14-21-20(23-19(15)25)22-16-7-9-17(10-8-16)24-12-4-3-5-13-24/h6-11,14H,2-5,12-13H2,1H3,(H,21,22,23)
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Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6239
PNG
(2-(4-Dimethylaminophenylamino)-8-ethyl-8H-pyrido-[...)
Show SMILES CCn1c2nc(Nc3ccc(cc3)N(C)C)ncc2ccc1=O
Show InChI InChI=1S/C17H19N5O/c1-4-22-15(23)10-5-12-11-18-17(20-16(12)22)19-13-6-8-14(9-7-13)21(2)3/h5-11H,4H2,1-3H3,(H,18,19,20)
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n/an/a 330n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM6221
PNG
(8-Ethyl-2-phenylamino-8H-pyrido[2,3-d]pyrimidin-7-...)
Show SMILES CCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C15H14N4O/c1-2-19-13(20)9-8-11-10-16-15(18-14(11)19)17-12-6-4-3-5-7-12/h3-10H,2H2,1H3,(H,16,17,18)
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Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6269
PNG
(8-Bicyclo[2.2.1]hept-2-yl-2-[4-(2-diethylaminoetho...)
Show SMILES CCN(CC)CCOc1ccc(Nc2ncc3ccc(=O)n(C4CC5CCC4C5)c3n2)cc1 |THB:21:22:25.26:28|
Show InChI InChI=1S/C26H33N5O2/c1-3-30(4-2)13-14-33-22-10-8-21(9-11-22)28-26-27-17-20-7-12-24(32)31(25(20)29-26)23-16-18-5-6-19(23)15-18/h7-12,17-19,23H,3-6,13-16H2,1-2H3,(H,27,28,29)
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Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6248
PNG
(2-(phenylamino)-8-propyl-7H,8H-pyrido[2,3-d]pyrimi...)
Show SMILES CCCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C16H16N4O/c1-2-10-20-14(21)9-8-12-11-17-16(19-15(12)20)18-13-6-4-3-5-7-13/h3-9,11H,2,10H2,1H3,(H,17,18,19)
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n/an/a 553n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6234
PNG
(8-Ethyl-2-(4-hydroxyphenylamino)-8H-pyrido[2,3-d]p...)
Show SMILES CCn1c2nc(Nc3ccc(O)cc3)ncc2ccc1=O
Show InChI InChI=1S/C15H14N4O2/c1-2-19-13(21)8-3-10-9-16-15(18-14(10)19)17-11-4-6-12(20)7-5-11/h3-9,20H,2H2,1H3,(H,16,17,18)
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n/an/a 585n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6233
PNG
(8-Ethyl-2-(4-methoxyphenylamino)-8H-pyrido[2,3-d]p...)
Show SMILES CCn1c2nc(Nc3ccc(OC)cc3)ncc2ccc1=O
Show InChI InChI=1S/C16H16N4O2/c1-3-20-14(21)9-4-11-10-17-16(19-15(11)20)18-12-5-7-13(22-2)8-6-12/h4-10H,3H2,1-2H3,(H,17,18,19)
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n/an/a 600n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6221
PNG
(8-Ethyl-2-phenylamino-8H-pyrido[2,3-d]pyrimidin-7-...)
Show SMILES CCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C15H14N4O/c1-2-19-13(20)9-8-11-10-16-15(18-14(11)19)17-12-6-4-3-5-7-12/h3-10H,2H2,1H3,(H,16,17,18)
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n/an/a 620n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 1 (CDK1)


(Homo sapiens (Human))
BDBM6274
PNG
(2-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-8-(pro...)
Show SMILES CC(C)n1c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2ccc1=O
Show InChI InChI=1S/C21H26N6O/c1-15(2)27-19(28)9-4-16-14-22-21(24-20(16)27)23-17-5-7-18(8-6-17)26-12-10-25(3)11-13-26/h4-9,14-15H,10-13H2,1-3H3,(H,22,23,24)
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Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6244
PNG
(8-Ethyl-2-{4-[4-(3-hydroxypropyl)piperazin-1-yl]ph...)
Show SMILES CCn1c2nc(Nc3ccc(cc3)N3CCC(CCCO)CC3)ncc2ccc1=O
Show InChI InChI=1S/C23H29N5O2/c1-2-28-21(30)10-5-18-16-24-23(26-22(18)28)25-19-6-8-20(9-7-19)27-13-11-17(12-14-27)4-3-15-29/h5-10,16-17,29H,2-4,11-15H2,1H3,(H,24,25,26)
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Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6259
PNG
(8-Benzyl-2-phenylamino-8H-pyrido[2,3-d]pyrimidin-7...)
Show SMILES O=c1ccc2cnc(Nc3ccccc3)nc2n1Cc1ccccc1
Show InChI InChI=1S/C20H16N4O/c25-18-12-11-16-13-21-20(22-17-9-5-2-6-10-17)23-19(16)24(18)14-15-7-3-1-4-8-15/h1-13H,14H2,(H,21,22,23)
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n/an/a 940n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 1 (CDK1)


(Homo sapiens (Human))
BDBM6221
PNG
(8-Ethyl-2-phenylamino-8H-pyrido[2,3-d]pyrimidin-7-...)
Show SMILES CCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C15H14N4O/c1-2-19-13(20)9-8-11-10-16-15(18-14(11)19)17-12-6-4-3-5-7-12/h3-10H,2H2,1H3,(H,16,17,18)
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n/an/a 1.02E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6230
PNG
(8-Ethyl-2-(pyridin-4-ylamino)-8H-pyrido[2,3-d]pyri...)
Show SMILES CCn1c2nc(Nc3ccncc3)ncc2ccc1=O
Show InChI InChI=1S/C14H13N5O/c1-2-19-12(20)4-3-10-9-16-14(18-13(10)19)17-11-5-7-15-8-6-11/h3-9H,2H2,1H3,(H,15,16,17,18)
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n/an/a 1.17E+3n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
CDK2/CycE


(Homo sapiens (Human))
BDBM6231
PNG
(8-Ethyl-2-[3-(1,1,2,2-tetrafluoroethoxy)phenylamin...)
Show SMILES CCn1c2nc(Nc3cccc(OC(F)(F)C(F)F)c3)ncc2ccc1=O
Show InChI InChI=1S/C17H14F4N4O2/c1-2-25-13(26)7-6-10-9-22-16(24-14(10)25)23-11-4-3-5-12(8-11)27-17(20,21)15(18)19/h3-9,15H,2H2,1H3,(H,22,23,24)
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n/an/a 1.20E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6228
PNG
(8-Ethyl-2-(4-fluorophenylamino)-8H-pyrido[2,3-d]py...)
Show SMILES CCn1c2nc(Nc3ccc(F)cc3)ncc2ccc1=O
Show InChI InChI=1S/C15H13FN4O/c1-2-20-13(21)8-3-10-9-17-15(19-14(10)20)18-12-6-4-11(16)5-7-12/h3-9H,2H2,1H3,(H,17,18,19)
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n/an/a 1.24E+3n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6229
PNG
(8-Ethyl-2-(3-fluorophenylamino)-8H-pyrido[2,3-d]py...)
Show SMILES CCn1c2nc(Nc3cccc(F)c3)ncc2ccc1=O
Show InChI InChI=1S/C15H13FN4O/c1-2-20-13(21)7-6-10-9-17-15(19-14(10)20)18-12-5-3-4-11(16)8-12/h3-9H,2H2,1H3,(H,17,18,19)
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n/an/a 1.40E+3n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6241
PNG
(2-(4-Diethylaminophenylamino)-8-ethyl-8H-pyrido[2,...)
Show SMILES CCN(CC)c1ccc(Nc2ncc3ccc(=O)n(CC)c3n2)cc1
Show InChI InChI=1S/C19H23N5O/c1-4-23(5-2)16-10-8-15(9-11-16)21-19-20-13-14-7-12-17(25)24(6-3)18(14)22-19/h7-13H,4-6H2,1-3H3,(H,20,21,22)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6250
PNG
(8-Butyl-2-phenylamino-8H-pyrido[2,3-d]pyrimidin-7-...)
Show SMILES CCCCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C17H18N4O/c1-2-3-11-21-15(22)10-9-13-12-18-17(20-16(13)21)19-14-7-5-4-6-8-14/h4-10,12H,2-3,11H2,1H3,(H,18,19,20)
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n/an/a 1.50E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6271
PNG
(8-(2,3-Dihydroxypropyl)-2-[4-(4-methylpiperazin-1-...)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CC(O)CO)c3n2)cc1
Show InChI InChI=1S/C21H26N6O3/c1-25-8-10-26(11-9-25)17-5-3-16(4-6-17)23-21-22-12-15-2-7-19(30)27(20(15)24-21)13-18(29)14-28/h2-7,12,18,28-29H,8-11,13-14H2,1H3,(H,22,23,24)
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n/an/a 1.65E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6257
PNG
(8-Phenyl-2-phenylamino-8H-pyrido[2,3-d]pyrimidin-7...)
Show SMILES O=c1ccc2cnc(Nc3ccccc3)nc2n1-c1ccccc1
Show InChI InChI=1S/C19H14N4O/c24-17-12-11-14-13-20-19(21-15-7-3-1-4-8-15)22-18(14)23(17)16-9-5-2-6-10-16/h1-13H,(H,20,21,22)
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n/an/a 1.67E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6236
PNG
(8-Ethyl-2-(4-hydroxy-3-methoxyphenylamino)-8H-pyri...)
Show SMILES CCn1c2nc(Nc3ccc(O)c(OC)c3)ncc2ccc1=O
Show InChI InChI=1S/C16H16N4O3/c1-3-20-14(22)7-4-10-9-17-16(19-15(10)20)18-11-5-6-12(21)13(8-11)23-2/h4-9,21H,3H2,1-2H3,(H,17,18,19)
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n/an/a 1.83E+3n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 1 (CDK1)


(Homo sapiens (Human))
BDBM6250
PNG
(8-Butyl-2-phenylamino-8H-pyrido[2,3-d]pyrimidin-7-...)
Show SMILES CCCCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C17H18N4O/c1-2-3-11-21-15(22)10-9-13-12-18-17(20-16(13)21)19-14-7-5-4-6-8-14/h4-10,12H,2-3,11H2,1H3,(H,18,19,20)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6270
PNG
(8-(2-Benzyloxyethyl)-2-[4-(4-methylpiperazin-1-yl)...)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCOCc4ccccc4)c3n2)cc1
Show InChI InChI=1S/C27H30N6O2/c1-31-13-15-32(16-14-31)24-10-8-23(9-11-24)29-27-28-19-22-7-12-25(34)33(26(22)30-27)17-18-35-20-21-5-3-2-4-6-21/h2-12,19H,13-18,20H2,1H3,(H,28,29,30)
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n/an/a 2.10E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6237
PNG
(8-Ethyl-2-[4-(2-methoxyethoxy)phenylamino]-8H-pyri...)
Show SMILES CCn1c2nc(Nc3ccc(OCCOC)cc3)ncc2ccc1=O
Show InChI InChI=1S/C18H20N4O3/c1-3-22-16(23)9-4-13-12-19-18(21-17(13)22)20-14-5-7-15(8-6-14)25-11-10-24-2/h4-9,12H,3,10-11H2,1-2H3,(H,19,20,21)
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n/an/a 2.33E+3n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6240
PNG
(8-Ethyl-2-(4-pyrrol-1-ylphenylamino)-8H-pyrido[2,3...)
Show SMILES CCn1c2nc(Nc3ccc(cc3)-n3cccc3)ncc2ccc1=O
Show InChI InChI=1S/C19H17N5O/c1-2-24-17(25)10-5-14-13-20-19(22-18(14)24)21-15-6-8-16(9-7-15)23-11-3-4-12-23/h3-13H,2H2,1H3,(H,20,21,22)
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n/an/a 2.75E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6261
PNG
(8-(2-Methoxyethyl)-2-phenylamino-8H-pyrido[2,3-d]p...)
Show SMILES COCCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C16H16N4O2/c1-22-10-9-20-14(21)8-7-12-11-17-16(19-15(12)20)18-13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H,17,18,19)
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n/an/a 2.86E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM6221
PNG
(8-Ethyl-2-phenylamino-8H-pyrido[2,3-d]pyrimidin-7-...)
Show SMILES CCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C15H14N4O/c1-2-19-13(20)9-8-11-10-16-15(18-14(11)19)17-12-6-4-3-5-7-12/h3-10H,2H2,1H3,(H,16,17,18)
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n/an/a 3.30E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6225
PNG
(2-(cyclohexylamino)-8-ethyl-7H,8H-pyrido[2,3-d]pyr...)
Show SMILES CCn1c2nc(NC3CCCCC3)ncc2ccc1=O
Show InChI InChI=1S/C15H20N4O/c1-2-19-13(20)9-8-11-10-16-15(18-14(11)19)17-12-6-4-3-5-7-12/h8-10,12H,2-7H2,1H3,(H,16,17,18)
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n/an/a 3.30E+3n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6235
PNG
(2-(3,4-Dimethoxyphenylamino)-8-ethyl-8H-pyrido[2,3...)
Show SMILES CCn1c2nc(Nc3ccc(OC)c(OC)c3)ncc2ccc1=O
Show InChI InChI=1S/C17H18N4O3/c1-4-21-15(22)8-5-11-10-18-17(20-16(11)21)19-12-6-7-13(23-2)14(9-12)24-3/h5-10H,4H2,1-3H3,(H,18,19,20)
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n/an/a 4.08E+3n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6260
PNG
(8-(methoxymethyl)-2-(phenylamino)-7H,8H-pyrido[2,3...)
Show SMILES COCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C15H14N4O2/c1-21-10-19-13(20)8-7-11-9-16-15(18-14(11)19)17-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,16,17,18)
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n/an/a 4.15E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6223
PNG
(8-Ethyl-2-isopropylamino-8H-pyrido[2,3-d]pyrimidin...)
Show SMILES CCn1c2nc(NC(C)C)ncc2ccc1=O
Show InChI InChI=1S/C12H16N4O/c1-4-16-10(17)6-5-9-7-13-12(14-8(2)3)15-11(9)16/h5-8H,4H2,1-3H3,(H,13,14,15)
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n/an/a 4.33E+3n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6263
PNG
(8-(oxiran-2-ylmethyl)-2-(phenylamino)-7H,8H-pyrido...)
Show SMILES O=c1ccc2cnc(Nc3ccccc3)nc2n1CC1CO1
Show InChI InChI=1S/C16H14N4O2/c21-14-7-6-11-8-17-16(18-12-4-2-1-3-5-12)19-15(11)20(14)9-13-10-22-13/h1-8,13H,9-10H2,(H,17,18,19)
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n/an/a 5.00E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6224
PNG
(2-(tert-butylamino)-8-ethyl-7H,8H-pyrido[2,3-d]pyr...)
Show SMILES CCn1c2nc(NC(C)(C)C)ncc2ccc1=O
Show InChI InChI=1S/C13H18N4O/c1-5-17-10(18)7-6-9-8-14-12(15-11(9)17)16-13(2,3)4/h6-8H,5H2,1-4H3,(H,14,15,16)
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n/an/a 5.25E+3n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM6250
PNG
(8-Butyl-2-phenylamino-8H-pyrido[2,3-d]pyrimidin-7-...)
Show SMILES CCCCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C17H18N4O/c1-2-3-11-21-15(22)10-9-13-12-18-17(20-16(13)21)19-14-7-5-4-6-8-14/h4-10,12H,2-3,11H2,1H3,(H,18,19,20)
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n/an/a 5.29E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6246
PNG
(8-Methyl-2-phenylamino-8H-pyrido[2,3-d]pyrimidin-7...)
Show SMILES Cn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C14H12N4O/c1-18-12(19)8-7-10-9-15-14(17-13(10)18)16-11-5-3-2-4-6-11/h2-9H,1H3,(H,15,16,17)
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n/an/a 5.48E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM6248
PNG
(2-(phenylamino)-8-propyl-7H,8H-pyrido[2,3-d]pyrimi...)
Show SMILES CCCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C16H16N4O/c1-2-10-20-14(21)9-8-12-11-17-16(19-15(12)20)18-13-6-4-3-5-7-13/h3-9,11H,2,10H2,1H3,(H,17,18,19)
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n/an/a 6.60E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6262
PNG
(8-(2-Ethoxyethyl)-2-phenylamino-8H-pyrido[2,3-d]py...)
Show SMILES CCOCCn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C17H18N4O2/c1-2-23-11-10-21-15(22)9-8-13-12-18-17(20-16(13)21)19-14-6-4-3-5-7-14/h3-9,12H,2,10-11H2,1H3,(H,18,19,20)
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n/an/a 7.80E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6231
PNG
(8-Ethyl-2-[3-(1,1,2,2-tetrafluoroethoxy)phenylamin...)
Show SMILES CCn1c2nc(Nc3cccc(OC(F)(F)C(F)F)c3)ncc2ccc1=O
Show InChI InChI=1S/C17H14F4N4O2/c1-2-25-13(26)7-6-10-9-22-16(24-14(10)25)23-11-4-3-5-12(8-11)27-17(20,21)15(18)19/h3-9,15H,2H2,1H3,(H,22,23,24)
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n/an/a 7.83E+3n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM6280
PNG
(8-Bicyclo[2.2.1]hept-2-yl-2-{4-[4-(3-hydroxypropyl...)
Show SMILES OCCCC1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(C4CC5CCC4C5)c3n2)cc1 |THB:23:24:27.28:30|
Show InChI InChI=1S/C28H35N5O2/c34-15-1-2-19-11-13-32(14-12-19)24-8-6-23(7-9-24)30-28-29-18-22-5-10-26(35)33(27(22)31-28)25-17-20-3-4-21(25)16-20/h5-10,18-21,25,34H,1-4,11-17H2,(H,29,30,31)
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n/an/a 8.62E+3n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6222
PNG
(8-Ethyl-2-ethylamino-8H-pyrido[2,3-d]pyrimidin-7-o...)
Show SMILES CCNc1ncc2ccc(=O)n(CC)c2n1
Show InChI InChI=1S/C11H14N4O/c1-3-12-11-13-7-8-5-6-9(16)15(4-2)10(8)14-11/h5-7H,3-4H2,1-2H3,(H,12,13,14)
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n/an/a 1.20E+4n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6258
PNG
(8-(cyclohexylmethyl)-2-(phenylamino)-7H,8H-pyrido[...)
Show SMILES O=c1ccc2cnc(Nc3ccccc3)nc2n1CC1CCCCC1
Show InChI InChI=1S/C20H22N4O/c25-18-12-11-16-13-21-20(22-17-9-5-2-6-10-17)23-19(16)24(18)14-15-7-3-1-4-8-15/h2,5-6,9-13,15H,1,3-4,7-8,14H2,(H,21,22,23)
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n/an/a 1.35E+4n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6264
PNG
((7-Oxo-2-phenylamino-7H-pyrido[2,3-d]pyrimidin-8-y...)
Show SMILES COC(=O)Cn1c2nc(Nc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C16H14N4O3/c1-23-14(22)10-20-13(21)8-7-11-9-17-16(19-15(11)20)18-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,18,19)
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n/an/a 3.10E+4n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6227
PNG
(8-Ethyl-2-(methylphenylamino)-8H-pyrido[2,3-d]pyri...)
Show SMILES CCn1c2nc(ncc2ccc1=O)N(C)c1ccccc1
Show InChI InChI=1S/C16H16N4O/c1-3-20-14(21)10-9-12-11-17-16(18-15(12)20)19(2)13-7-5-4-6-8-13/h4-11H,3H2,1-2H3
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n/an/a>4.00E+4n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6232
PNG
(8-ethyl-2-[(3-methoxyphenyl)amino]-7H,8H-pyrido[2,...)
Show SMILES CCn1c2nc(Nc3cccc(OC)c3)ncc2ccc1=O
Show InChI InChI=1S/C16H16N4O2/c1-3-20-14(21)8-7-11-10-17-16(19-15(11)20)18-12-5-4-6-13(9-12)22-2/h4-10H,3H2,1-2H3,(H,17,18,19)
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n/an/a>4.00E+4n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 1 (CDK1)


(Homo sapiens (Human))
BDBM6280
PNG
(8-Bicyclo[2.2.1]hept-2-yl-2-{4-[4-(3-hydroxypropyl...)
Show SMILES OCCCC1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(C4CC5CCC4C5)c3n2)cc1 |THB:23:24:27.28:30|
Show InChI InChI=1S/C28H35N5O2/c34-15-1-2-19-11-13-32(14-12-19)24-8-6-23(7-9-24)30-28-29-18-22-5-10-26(35)33(27(22)31-28)25-17-20-3-4-21(25)16-20/h5-10,18-21,25,34H,1-4,11-17H2,(H,29,30,31)
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n/an/a>4.00E+4n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 12 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4)


(Homo sapiens (Human))
BDBM6226
PNG
(2-(benzylamino)-8-ethyl-7H,8H-pyrido[2,3-d]pyrimid...)
Show SMILES CCn1c2nc(NCc3ccccc3)ncc2ccc1=O
Show InChI InChI=1S/C16H16N4O/c1-2-20-14(21)9-8-13-11-18-16(19-15(13)20)17-10-12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3,(H,17,18,19)
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n/an/a>4.00E+4n/an/an/an/a7.425



Parke-Davis Pharmaceutical Research



Assay Description
The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM6231
PNG
(8-Ethyl-2-[3-(1,1,2,2-tetrafluoroethoxy)phenylamin...)
Show SMILES CCn1c2nc(Nc3cccc(OC(F)(F)C(F)F)c3)ncc2ccc1=O
Show InChI InChI=1S/C17H14F4N4O2/c1-2-25-13(26)7-6-10-9-22-16(24-14(10)25)23-11-4-3-5-12(8-11)27-17(20,21)15(18)19/h3-9,15H,2H2,1H3,(H,22,23,24)
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n/an/a 4.42E+4n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


J Med Chem 43: 4606-16 (2000)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q25B00N4
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%