Compile Data Set for Download or QSAR
Found 160 Enz. Inhib. hit(s) with all data for entry = 50026180
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271235((4Z)-6-(3-Hydroxyphenyl)-4-({[4-piperidin-1-ylmeth...)
Show SMILES Oc1cccc(c1)-c1ccc2C(=O)NC(=O)C(=CNc3ccc(CN4CCCCC4)cc3)c2c1
Show InChI InChI=1S/C28H27N3O3/c32-23-6-4-5-20(15-23)21-9-12-24-25(16-21)26(28(34)30-27(24)33)17-29-22-10-7-19(8-11-22)18-31-13-2-1-3-14-31/h4-12,15-17,29,32H,1-3,13-14,18H2,(H,30,33,34)
Affinity DataIC50: 27nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM28077((4Z)-6-(furan-3-yl)-4-({[4-(piperidin-1-ylmethyl)p...)
Show SMILES O=C1NC(=O)c2ccc(cc2C1=CNc1ccc(CN2CCCCC2)cc1)-c1ccoc1
Show InChI InChI=1S/C26H25N3O3/c30-25-22-9-6-19(20-10-13-32-17-20)14-23(22)24(26(31)28-25)15-27-21-7-4-18(5-8-21)16-29-11-2-1-3-12-29/h4-10,13-15,17,27H,1-3,11-12,16H2,(H,28,30,31)
Affinity DataIC50: 37nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271236((4Z)-6-(4-Hydroxyphenyl)-4-({[4-piperidin-1-ylmeth...)
Show SMILES Oc1ccc(cc1)-c1ccc2C(=O)NC(=O)C(=CNc3ccc(CN4CCCCC4)cc3)c2c1
Show InChI InChI=1S/C28H27N3O3/c32-23-11-6-20(7-12-23)21-8-13-24-25(16-21)26(28(34)30-27(24)33)17-29-22-9-4-19(5-10-22)18-31-14-2-1-3-15-31/h4-13,16-17,29,32H,1-3,14-15,18H2,(H,30,33,34)
Affinity DataIC50: 41nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271199((4Z)-4-({[4-(Piperidin-1-ylmethyl)phenyl]amino}met...)
Show SMILES O=C1NC(=O)c2ccc(cc2C1=CNc1ccc(CN2CCCCC2)cc1)-c1cccnc1
Show InChI InChI=1S/C27H26N4O2/c32-26-23-11-8-20(21-5-4-12-28-16-21)15-24(23)25(27(33)30-26)17-29-22-9-6-19(7-10-22)18-31-13-2-1-3-14-31/h4-12,15-17,29H,1-3,13-14,18H2,(H,30,32,33)
Affinity DataIC50: 50nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270643((4Z)-4-({[3-Fluoro-4-(4-methylpiperazin-1-yl)pheny...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(cc23)-c2ccoc2)cc1F
Show InChI InChI=1S/C25H23FN4O3/c1-29-7-9-30(10-8-29)23-5-3-18(13-22(23)26)27-14-21-20-12-16(17-6-11-33-15-17)2-4-19(20)24(31)28-25(21)32/h2-6,11-15,27H,7-10H2,1H3,(H,28,31,32)
Affinity DataIC50: 80nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271036((4Z)-4-({[4-(4-Methylpiperazin-1-yl)phenyl]amino}m...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(cc23)-c2ccsc2)cc1
Show InChI InChI=1S/C25H24N4O2S/c1-28-9-11-29(12-10-28)20-5-3-19(4-6-20)26-15-23-22-14-17(18-8-13-32-16-18)2-7-21(22)24(30)27-25(23)31/h2-8,13-16,26H,9-12H2,1H3,(H,27,30,31)
Affinity DataIC50: 100nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270579((4Z)-6-(3-Furyl)-4-({[6-(4-methylpiperazin-1-yl)py...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(cc23)-c2ccoc2)cn1
Show InChI InChI=1S/C24H23N5O3/c1-28-7-9-29(10-8-28)22-5-3-18(13-26-22)25-14-21-20-12-16(17-6-11-32-15-17)2-4-19(20)23(30)27-24(21)31/h2-6,11-15,25H,7-10H2,1H3,(H,27,30,31)
Affinity DataIC50: 110nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271037(4-[(4Z)-4-({[4-(4-Methylpiperazin-1-yl)phenyl]amin...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(cc23)-c2ccc(C=O)cc2)cc1
Show InChI InChI=1S/C28H26N4O3/c1-31-12-14-32(15-13-31)23-9-7-22(8-10-23)29-17-26-25-16-21(20-4-2-19(18-33)3-5-20)6-11-24(25)27(34)30-28(26)35/h2-11,16-18,29H,12-15H2,1H3,(H,30,34,35)
Affinity DataIC50: 130nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271267((4Z)-6-(4-Methoxyphenyl)-4-({[4-(piperidin-1-ylmet...)
Show SMILES COc1ccc(cc1)-c1ccc2C(=O)NC(=O)C(=CNc3ccc(CN4CCCCC4)cc3)c2c1
Show InChI InChI=1S/C29H29N3O3/c1-35-24-12-7-21(8-13-24)22-9-14-25-26(17-22)27(29(34)31-28(25)33)18-30-23-10-5-20(6-11-23)19-32-15-3-2-4-16-32/h5-14,17-18,30H,2-4,15-16,19H2,1H3,(H,31,33,34)
Affinity DataIC50: 130nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271200((4Z)-4-({[4-Piperidin-1-ylmethyl]phenyl}amino)meth...)
Show SMILES O=C1NC(=O)c2ccc(cc2C1=CNc1ccc(CN2CCCCC2)cc1)-c1ccsc1
Show InChI InChI=1S/C26H25N3O2S/c30-25-22-9-6-19(20-10-13-32-17-20)14-23(22)24(26(31)28-25)15-27-21-7-4-18(5-8-21)16-29-11-2-1-3-12-29/h4-10,13-15,17,27H,1-3,11-12,16H2,(H,28,30,31)
Affinity DataIC50: 130nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270522((4Z)-6-(3-Furyl)-4-({[5-(4-methylpiperazin-1-yl)py...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(cc23)-c2ccoc2)nc1
Show InChI InChI=1S/C24H23N5O3/c1-28-7-9-29(10-8-28)18-3-5-22(25-13-18)26-14-21-20-12-16(17-6-11-32-15-17)2-4-19(20)23(30)27-24(21)31/h2-6,11-15H,7-10H2,1H3,(H,25,26)(H,27,30,31)
Affinity DataIC50: 130nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271115((4Z)-4-({[4 Piperidin-1-ylmethyl]phenyl}amino)meth...)
Show SMILES O=C1NC(=O)c2ccc(cc2C1=CNc1ccc(CN2CCCCC2)cc1)-n1cccc1
Show InChI InChI=1S/C26H26N4O2/c31-25-22-11-10-21(30-14-4-5-15-30)16-23(22)24(26(32)28-25)17-27-20-8-6-19(7-9-20)18-29-12-2-1-3-13-29/h4-11,14-17,27H,1-3,12-13,18H2,(H,28,31,32)
Affinity DataIC50: 140nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270775((4Z)-4-({[4-(4-Methylpiperazin-1-yl)phenyl]amino}m...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(cc23)-n2cccc2)cc1
Show InChI InChI=1S/C25H25N5O2/c1-28-12-14-30(15-13-28)19-6-4-18(5-7-19)26-17-23-22-16-20(29-10-2-3-11-29)8-9-21(22)24(31)27-25(23)32/h2-11,16-17,26H,12-15H2,1H3,(H,27,31,32)
Affinity DataIC50: 140nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270881((4Z)-6-(3-Furyl)-4-({[4-(4-methylpiperazin-1-yl)ph...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(cc23)-c2ccoc2)cc1
Show InChI InChI=1S/C25H24N4O3/c1-28-9-11-29(12-10-28)20-5-3-19(4-6-20)26-15-23-22-14-17(18-8-13-32-16-18)2-7-21(22)24(30)27-25(23)31/h2-8,13-16,26H,9-12H2,1H3,(H,27,30,31)
Affinity DataIC50: 220nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270644((4Z)-6-(3-Furyl)-4-({[2-(4-methylpiperazin-1-yl)py...)
Show SMILES CN1CCN(CC1)c1ncc(NC=C2C(=O)NC(=O)c3ccc(cc23)-c2ccoc2)cn1
Show InChI InChI=1S/C23H22N6O3/c1-28-5-7-29(8-6-28)23-25-11-17(12-26-23)24-13-20-19-10-15(16-4-9-32-14-16)2-3-18(19)21(30)27-22(20)31/h2-4,9-14,24H,5-8H2,1H3,(H,27,30,31)
Affinity DataIC50: 250nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271089((4Z)-6-Iodo-4-({[4-(piperidin-1-ylmethyl)phenyl]am...)
Show SMILES Ic1ccc2C(=O)NC(=O)C(=CNc3ccc(CN4CCCCC4)cc3)c2c1
Show InChI InChI=1S/C22H22IN3O2/c23-16-6-9-18-19(12-16)20(22(28)25-21(18)27)13-24-17-7-4-15(5-8-17)14-26-10-2-1-3-11-26/h4-9,12-13,24H,1-3,10-11,14H2,(H,25,27,28)
Affinity DataIC50: 300nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271201((4Z)-6-(4-Fluorophenyl)-4-({[4-(piperidin-1-ylmeth...)
Show SMILES Fc1ccc(cc1)-c1ccc2C(=O)NC(=O)C(=CNc3ccc(CN4CCCCC4)cc3)c2c1
Show InChI InChI=1S/C28H26FN3O2/c29-22-9-6-20(7-10-22)21-8-13-24-25(16-21)26(28(34)31-27(24)33)17-30-23-11-4-19(5-12-23)18-32-14-2-1-3-15-32/h4-13,16-17,30H,1-3,14-15,18H2,(H,31,33,34)
Affinity DataIC50: 310nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271146((4Z)-6-Phenyl-4-({[4-piperidin-1-ylmethyl]phenyl}a...)
Show SMILES O=C1NC(=O)c2ccc(cc2C1=CNc1ccc(CN2CCCCC2)cc1)-c1ccccc1
Show InChI InChI=1S/C28H27N3O2/c32-27-24-14-11-22(21-7-3-1-4-8-21)17-25(24)26(28(33)30-27)18-29-23-12-9-20(10-13-23)19-31-15-5-2-6-16-31/h1,3-4,7-14,17-18,29H,2,5-6,15-16,19H2,(H,30,32,33)
Affinity DataIC50: 320nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270735(6-Iodo-4-{[4-(5-methyl-2,5-diaza-bicyclo[2.2.1]hep...)
Show SMILES CN1CC2CC1CN2c1ccc(NC=C2C(=O)NC(=O)c3ccc(I)cc23)cc1
Show InChI InChI=1S/C22H21IN4O2/c1-26-11-17-9-16(26)12-27(17)15-5-3-14(4-6-15)24-10-20-19-8-13(23)2-7-18(19)21(28)25-22(20)29/h2-8,10,16-17,24H,9,11-12H2,1H3,(H,25,28,29)
Affinity DataIC50: 320nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270880((4Z)-6-(2-Furyl)-4-({[4-(4-methylpiperazin-1-yl)ph...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(cc23)-c2ccco2)cc1
Show InChI InChI=1S/C25H24N4O3/c1-28-10-12-29(13-11-28)19-7-5-18(6-8-19)26-16-22-21-15-17(23-3-2-14-32-23)4-9-20(21)24(30)27-25(22)31/h2-9,14-16,26H,10-13H2,1H3,(H,27,30,31)
Affinity DataIC50: 330nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270879((4Z)-4-({[4-(4-Methylpiperazin-1-yl)phenyl]amino}m...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(cc23)-c2ccccc2)cc1
Show InChI InChI=1S/C27H26N4O2/c1-30-13-15-31(16-14-30)22-10-8-21(9-11-22)28-18-25-24-17-20(19-5-3-2-4-6-19)7-12-23(24)26(32)29-27(25)33/h2-12,17-18,28H,13-16H2,1H3,(H,29,32,33)
Affinity DataIC50: 390nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270773((4Z)-6-Iodo-4-({[4-(4-methylpiperazin-1-yl)phenyl]...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(I)cc23)cc1
Show InChI InChI=1S/C21H21IN4O2/c1-25-8-10-26(11-9-25)16-5-3-15(4-6-16)23-13-19-18-12-14(22)2-7-17(18)20(27)24-21(19)28/h2-7,12-13,23H,8-11H2,1H3,(H,24,27,28)
Affinity DataIC50: 480nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270642((4Z)-6-(3-Furyl)-4-({[6-(4-methylpiperazin-1-yl)py...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(cc23)-c2ccoc2)nn1
Show InChI InChI=1S/C23H22N6O3/c1-28-7-9-29(10-8-28)21-5-4-20(26-27-21)24-13-19-18-12-15(16-6-11-32-14-16)2-3-17(18)22(30)25-23(19)31/h2-6,11-14H,7-10H2,1H3,(H,24,26)(H,25,30,31)
Affinity DataIC50: 820nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271144((4Z)-6-Morpholin-4-yl-4-({[4-(piperidin-1-ylmethyl...)
Show SMILES O=C1NC(=O)c2ccc(cc2C1=CNc1ccc(CN2CCCCC2)cc1)N1CCOCC1
Show InChI InChI=1S/C26H30N4O3/c31-25-22-9-8-21(30-12-14-33-15-13-30)16-23(22)24(26(32)28-25)17-27-20-6-4-19(5-7-20)18-29-10-2-1-3-11-29/h4-9,16-17,27H,1-3,10-15,18H2,(H,28,31,32)
Affinity DataIC50: 920nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271270((4Z)-4-({[4-(3,5-Dimethylpiperazin-1-yl)phenyl]ami...)
Show SMILES C[C@H]1CN(C[C@@H](C)N1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(I)cc23)cc1
Show InChI InChI=1S/C22H23IN4O2/c1-13-11-27(12-14(2)25-13)17-6-4-16(5-7-17)24-10-20-19-9-15(23)3-8-18(19)21(28)26-22(20)29/h3-10,13-14,24-25H,11-12H2,1-2H3,(H,26,28,29)/t13-,14+
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271117((4Z)-6-Piperidin-1-yl-4-({[4-(piperidin-1-ylmethyl...)
Show SMILES O=C1NC(=O)c2ccc(cc2C1=CNc1ccc(CN2CCCCC2)cc1)N1CCCCC1
Show InChI InChI=1S/C27H32N4O2/c32-26-23-12-11-22(31-15-5-2-6-16-31)17-24(23)25(27(33)29-26)18-28-21-9-7-20(8-10-21)19-30-13-3-1-4-14-30/h7-12,17-18,28H,1-6,13-16,19H2,(H,29,32,33)
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM28047((4Z)-6-bromo-4-({[4-(piperidin-1-ylmethyl)phenyl]a...)
Show SMILES Brc1ccc2C(=O)NC(=O)C(=CNc3ccc(CN4CCCCC4)cc3)c2c1
Show InChI InChI=1S/C22H22BrN3O2/c23-16-6-9-18-19(12-16)20(22(28)25-21(18)27)13-24-17-7-4-15(5-8-17)14-26-10-2-1-3-11-26/h4-9,12-13,24H,1-3,10-11,14H2,(H,25,27,28)
Affinity DataIC50: 1.10E+3nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270645((4Z)-6-(3-Furyl)-4-({[5-(4-methylpiperazin-1-yl)py...)
Show SMILES CN1CCN(CC1)c1cnc(NC=C2C(=O)NC(=O)c3ccc(cc23)-c2ccoc2)cn1
Show InChI InChI=1S/C23H22N6O3/c1-28-5-7-29(8-6-28)21-13-25-20(12-26-21)24-11-19-18-10-15(16-4-9-32-14-16)2-3-17(18)22(30)27-23(19)31/h2-4,9-14H,5-8H2,1H3,(H,24,25)(H,27,30,31)
Affinity DataIC50: 1.25E+3nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270734((4Z)-6-Bromo-4-({[4-(4-methylpiperazin-1-yl)phenyl...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(Br)cc23)cc1
Show InChI InChI=1S/C21H21BrN4O2/c1-25-8-10-26(11-9-25)16-5-3-15(4-6-16)23-13-19-18-12-14(22)2-7-17(18)20(27)24-21(19)28/h2-7,12-13,23H,8-11H2,1H3,(H,24,27,28)
Affinity DataIC50: 1.40E+3nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270878((4Z)-6-Piperidin-1-yl-4-({[4-(methylpiperazin-1-yl...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(cc23)N2CCCCC2)cc1
Show InChI InChI=1S/C26H31N5O2/c1-29-13-15-31(16-14-29)20-7-5-19(6-8-20)27-18-24-23-17-21(30-11-3-2-4-12-30)9-10-22(23)25(32)28-26(24)33/h5-10,17-18,27H,2-4,11-16H2,1H3,(H,28,32,33)
Affinity DataIC50: 1.62E+3nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM28050((4Z)-6-(phenylamino)-4-({[4-(piperidin-1-ylmethyl)...)
Show SMILES O=C1NC(=O)c2ccc(Nc3ccccc3)cc2C1=CNc1ccc(CN2CCCCC2)cc1
Show InChI InChI=1S/C28H28N4O2/c33-27-24-14-13-23(30-22-7-3-1-4-8-22)17-25(24)26(28(34)31-27)18-29-21-11-9-20(10-12-21)19-32-15-5-2-6-16-32/h1,3-4,7-14,17-18,29-30H,2,5-6,15-16,19H2,(H,31,33,34)
Affinity DataIC50: 1.80E+3nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271086(6-Methoxy-4-[(4-piperidin-1-ylmethyl-phenylamino)-...)
Show SMILES COc1ccc2C(=O)NC(=O)C(=CNc3ccc(CN4CCCCC4)cc3)c2c1
Show InChI InChI=1S/C23H25N3O3/c1-29-18-9-10-19-20(13-18)21(23(28)25-22(19)27)14-24-17-7-5-16(6-8-17)15-26-11-3-2-4-12-26/h5-10,13-14,24H,2-4,11-12,15H2,1H3,(H,25,27,28)
Affinity DataIC50: 2.00E+3nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 1(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270645((4Z)-6-(3-Furyl)-4-({[5-(4-methylpiperazin-1-yl)py...)
Show SMILES CN1CCN(CC1)c1cnc(NC=C2C(=O)NC(=O)c3ccc(cc23)-c2ccoc2)cn1
Show InChI InChI=1S/C23H22N6O3/c1-28-5-7-29(8-6-28)21-13-25-20(12-26-21)24-11-19-18-10-15(16-4-9-32-14-16)2-3-17(18)22(30)27-23(19)31/h2-4,9-14H,5-8H2,1H3,(H,24,25)(H,27,30,31)
Affinity DataIC50: 2.20E+3nMAssay Description:Inhibition of CDK1/Cyclin B1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271039((4Z)-4-({[4-(4-Methylpiperazin-1-yl)phenyl]amino}m...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(cc23)C#Cc2ccccc2)cc1
Show InChI InChI=1S/C29H26N4O2/c1-32-15-17-33(18-16-32)24-12-10-23(11-13-24)30-20-27-26-19-22(8-7-21-5-3-2-4-6-21)9-14-25(26)28(34)31-29(27)35/h2-6,9-14,19-20,30H,15-18H2,1H3,(H,31,34,35)
Affinity DataIC50: 2.30E+3nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271087((4Z)-6-Chloro-4-({[4-(piperidin-1-ylmethyl)phenyl]...)
Show SMILES Clc1ccc2C(=O)NC(=O)C(=CNc3ccc(CN4CCCCC4)cc3)c2c1
Show InChI InChI=1S/C22H22ClN3O2/c23-16-6-9-18-19(12-16)20(22(28)25-21(18)27)13-24-17-7-4-15(5-8-17)14-26-10-2-1-3-11-26/h4-9,12-13,24H,1-3,10-11,14H2,(H,25,27,28)
Affinity DataIC50: 2.50E+3nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270520((4Z)-4-({[4-(3,4-Dimethylpiperazin-1-yl)phenyl]ami...)
Show SMILES CC1CN(CCN1C)c1ccc(NC=C2C(=O)NC(=O)c3ccc(I)cc23)cc1
Show InChI InChI=1S/C22H23IN4O2/c1-14-13-27(10-9-26(14)2)17-6-4-16(5-7-17)24-12-20-19-11-15(23)3-8-18(19)21(28)25-22(20)29/h3-8,11-12,14,24H,9-10,13H2,1-2H3,(H,25,28,29)
Affinity DataIC50: 2.70E+3nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270519((4Z)-6-Iodo-4-[({4-[(3R,5S)-3,4,5-trimethylpiperaz...)
Show SMILES C[C@H]1CN(C[C@@H](C)N1C)c1ccc(NC=C2C(=O)NC(=O)c3ccc(I)cc23)cc1
Show InChI InChI=1S/C23H25IN4O2/c1-14-12-28(13-15(2)27(14)3)18-7-5-17(6-8-18)25-11-21-20-10-16(24)4-9-19(20)22(29)26-23(21)30/h4-11,14-15,25H,12-13H2,1-3H3,(H,26,29,30)/t14-,15+
Affinity DataIC50: 2.80E+3nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270521((4Z)-6-Iodo-4-[({4-[(2S,5R)-2,4,5-trimethylpiperaz...)
Show SMILES C[C@@H]1CN([C@@H](C)CN1C)c1ccc(NC=C2C(=O)NC(=O)c3ccc(I)cc23)cc1
Show InChI InChI=1S/C23H25IN4O2/c1-14-13-28(15(2)12-27(14)3)18-7-5-17(6-8-18)25-11-21-20-10-16(24)4-9-19(20)22(29)26-23(21)30/h4-11,14-15,25H,12-13H2,1-3H3,(H,26,29,30)/t14-,15+/m1/s1
Affinity DataIC50: 3.00E+3nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270732((4Z)-4-({[4-(Piperidin-1-ylmethyl)phenyl]amino}met...)
Show SMILES O=C1NC(=O)c2ccccc2C1=CNc1ccc(CN2CCCCC2)cc1
Show InChI InChI=1S/C22H23N3O2/c26-21-19-7-3-2-6-18(19)20(22(27)24-21)14-23-17-10-8-16(9-11-17)15-25-12-4-1-5-13-25/h2-3,6-11,14,23H,1,4-5,12-13,15H2,(H,24,26,27)
Affinity DataIC50: 3.30E+3nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271116(CHEMBL488548 | N-[(4Z)-1,3-Dioxo-4-({[4-piperidin-...)
Show SMILES CC(=O)Nc1ccc2C(=O)NC(=O)C(=CNc3ccc(CN4CCCCC4)cc3)c2c1
Show InChI InChI=1S/C24H26N4O3/c1-16(29)26-19-9-10-20-21(13-19)22(24(31)27-23(20)30)14-25-18-7-5-17(6-8-18)15-28-11-3-2-4-12-28/h5-10,13-14,25H,2-4,11-12,15H2,1H3,(H,26,29)(H,27,30,31)
Affinity DataIC50: 3.50E+3nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270700((4Z)-4-({[4-(4-Methylpiperazin-1-yl)phenyl]amino}m...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccccc23)cc1
Show InChI InChI=1S/C21H22N4O2/c1-24-10-12-25(13-11-24)16-8-6-15(7-9-16)22-14-19-17-4-2-3-5-18(17)20(26)23-21(19)27/h2-9,14,22H,10-13H2,1H3,(H,23,26,27)
Affinity DataIC50: 4.10E+3nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 1(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270736((4Z)-6-Nitro-4-({[4-(4-methylpiperazin-1-yl)phenyl...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(cc23)[N+]([O-])=O)cc1
Show InChI InChI=1S/C21H21N5O4/c1-24-8-10-25(11-9-24)15-4-2-14(3-5-15)22-13-19-18-12-16(26(29)30)6-7-17(18)20(27)23-21(19)28/h2-7,12-13,22H,8-11H2,1H3,(H,23,27,28)
Affinity DataIC50: 7.20E+3nMAssay Description:Inhibition of CDK1/Cyclin B1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 2(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271037(4-[(4Z)-4-({[4-(4-Methylpiperazin-1-yl)phenyl]amin...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(cc23)-c2ccc(C=O)cc2)cc1
Show InChI InChI=1S/C28H26N4O3/c1-31-12-14-32(15-13-31)23-9-7-22(8-10-23)29-17-26-25-16-21(20-4-2-19(18-33)3-5-20)6-11-24(25)27(34)30-28(26)35/h2-11,16-18,29H,12-15H2,1H3,(H,30,34,35)
Affinity DataIC50: 7.70E+3nMAssay Description:Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phospho...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 2(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271116(CHEMBL488548 | N-[(4Z)-1,3-Dioxo-4-({[4-piperidin-...)
Show SMILES CC(=O)Nc1ccc2C(=O)NC(=O)C(=CNc3ccc(CN4CCCCC4)cc3)c2c1
Show InChI InChI=1S/C24H26N4O3/c1-16(29)26-19-9-10-20-21(13-19)22(24(31)27-23(20)30)14-25-18-7-5-17(6-8-18)15-28-11-3-2-4-12-28/h5-10,13-14,25H,2-4,11-12,15H2,1H3,(H,26,29)(H,27,30,31)
Affinity DataIC50: 8.10E+3nMAssay Description:Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phospho...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 1(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50271037(4-[(4Z)-4-({[4-(4-Methylpiperazin-1-yl)phenyl]amin...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(cc23)-c2ccc(C=O)cc2)cc1
Show InChI InChI=1S/C28H26N4O3/c1-31-12-14-32(15-13-31)23-9-7-22(8-10-23)29-17-26-25-16-21(20-4-2-19(18-33)3-5-20)6-11-24(25)27(34)30-28(26)35/h2-11,16-18,29H,12-15H2,1H3,(H,30,34,35)
Affinity DataIC50: 8.20E+3nMAssay Description:Inhibition of CDK1/Cyclin B1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270702((4Z)-4-({[4-(Morpholin-4-ylmethyl)phenyl]amino}met...)
Show SMILES O=C1NC(=O)c2ccccc2C1=CNc1ccc(CN2CCOCC2)cc1
Show InChI InChI=1S/C21H21N3O3/c25-20-18-4-2-1-3-17(18)19(21(26)23-20)13-22-16-7-5-15(6-8-16)14-24-9-11-27-12-10-24/h1-8,13,22H,9-12,14H2,(H,23,25,26)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270776(CHEMBL487731 | N-[(4Z)-4-({[4-(4-Methylpiperazin-1...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(NC(C)=O)cc23)cc1
Show InChI InChI=1S/C23H25N5O3/c1-15(29)25-17-5-8-19-20(13-17)21(23(31)26-22(19)30)14-24-16-3-6-18(7-4-16)28-11-9-27(2)10-12-28/h3-8,13-14,24H,9-12H2,1-2H3,(H,25,29)(H,26,30,31)
Affinity DataIC50: 1.10E+4nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270736((4Z)-6-Nitro-4-({[4-(4-methylpiperazin-1-yl)phenyl...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(cc23)[N+]([O-])=O)cc1
Show InChI InChI=1S/C21H21N5O4/c1-24-8-10-25(11-9-24)15-4-2-14(3-5-15)22-13-19-18-12-16(26(29)30)6-7-17(18)20(27)23-21(19)28/h2-7,12-13,22H,8-11H2,1H3,(H,23,27,28)
Affinity DataIC50: 1.10E+4nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 4(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270733((4Z)-7-Bromo-4-({[4-(4-methylpiperazin-1-yl)phenyl...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3cc(Br)ccc23)cc1
Show InChI InChI=1S/C21H21BrN4O2/c1-25-8-10-26(11-9-25)16-5-3-15(4-6-16)23-13-19-17-7-2-14(22)12-18(17)20(27)24-21(19)28/h2-7,12-13,23H,8-11H2,1H3,(H,24,27,28)
Affinity DataIC50: 1.21E+4nMAssay Description:Inhibition of CDK4/cyclin D1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 1(Homo sapiens (Human))
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50270776(CHEMBL487731 | N-[(4Z)-4-({[4-(4-Methylpiperazin-1...)
Show SMILES CN1CCN(CC1)c1ccc(NC=C2C(=O)NC(=O)c3ccc(NC(C)=O)cc23)cc1
Show InChI InChI=1S/C23H25N5O3/c1-15(29)25-17-5-8-19-20(13-17)21(23(31)26-22(19)30)14-24-16-3-6-18(7-4-16)28-11-9-27(2)10-12-28/h3-8,13-14,24H,9-12H2,1-2H3,(H,25,29)(H,26,30,31)
Affinity DataIC50: 1.38E+4nMAssay Description:Inhibition of CDK1/Cyclin B1 (unknown origin) expressed in Sf9 cells-baculovirus system assessed as retinoblastoma susceptibility gene product phosph...More data for this Ligand-Target Pair
Displayed 1 to 50 (of 160 total ) | Next | Last >>
Jump to: