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Compile Data Set for Download or QSAR

Found 48 hits from Dr. Reddy's Laboratories   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218369
PNG
(CHEMBL237855 | N1-[4-phenyl-5-(6-phenyl[1,2,4]tria...)
Show SMILES ClCC(=O)Nc1cc(c(s1)-c1nnc2sc(nn12)-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C21H14ClN5OS2/c22-12-16(28)23-17-11-15(13-7-3-1-4-8-13)18(29-17)19-24-25-21-27(19)26-20(30-21)14-9-5-2-6-10-14/h1-11H,12H2,(H,23,28)
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n/an/a 28n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218357
PNG
(CHEMBL399188 | N1-[4-phenyl-5-(5H-[1,2,4]triazolo[...)
Show SMILES ClCC(=O)Nc1cc(c(s1)-c1nnc2Sc3nc4ccccc4nc3Nn12)-c1ccccc1
Show InChI InChI=1S/C22H14ClN7OS2/c23-11-16(31)26-17-10-13(12-6-2-1-3-7-12)18(32-17)20-27-28-22-30(20)29-19-21(33-22)25-15-9-5-4-8-14(15)24-19/h1-10H,11H2,(H,24,29)(H,26,31)
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n/an/a 30n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218337
PNG
(CHEMBL397170 | N1-[4-methyl-5-(6-phenyl[1,2,4]tria...)
Show SMILES Cc1cc(NC(=O)CCl)sc1-c1nnc2sc(nn12)-c1ccccc1
Show InChI InChI=1S/C16H12ClN5OS2/c1-9-7-12(18-11(23)8-17)24-13(9)14-19-20-16-22(14)21-15(25-16)10-5-3-2-4-6-10/h2-7H,8H2,1H3,(H,18,23)
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n/an/a 30n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218358
PNG
(CHEMBL238789 | N1-[4-methyl-5-(5H-[1,2,4]triazolo[...)
Show SMILES CC(=O)Nc1cc(C)c(s1)-c1nnc2Sc3nc4ccccc4nc3Nn12
Show InChI InChI=1S/C17H13N7OS2/c1-8-7-12(18-9(2)25)26-13(8)15-21-22-17-24(15)23-14-16(27-17)20-11-6-4-3-5-10(11)19-14/h3-7H,1-2H3,(H,18,25)(H,19,23)
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n/an/a 34n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218379
PNG
(CHEMBL237674 | N1-[4-phenyl-5-(6-phenyl[1,2,4]tria...)
Show SMILES CC(=O)Nc1cc(c(s1)-c1nnc2sc(nn12)-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C21H15N5OS2/c1-13(27)22-17-12-16(14-8-4-2-5-9-14)18(28-17)19-23-24-21-26(19)25-20(29-21)15-10-6-3-7-11-15/h2-12H,1H3,(H,22,27)
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n/an/a 38n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218354
PNG
(CHEMBL391315 | N1-[5-(6,7-diphenyl-5H-[1,2,4]triaz...)
Show SMILES CC(=O)Nc1cc(c(s1)-c1nnc2SC(C(=Nn12)c1ccccc1)c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C28H21N5OS2/c1-18(34)29-23-17-22(19-11-5-2-6-12-19)26(35-23)27-30-31-28-33(27)32-24(20-13-7-3-8-14-20)25(36-28)21-15-9-4-10-16-21/h2-17,25H,1H3,(H,29,34)
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n/an/a 40n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218356
PNG
(CHEMBL238105 | N1-[4-methyl-5-(6-phenyl[1,2,4]tria...)
Show SMILES CC(=O)Nc1cc(C)c(s1)-c1nnc2sc(nn12)-c1ccccc1
Show InChI InChI=1S/C16H13N5OS2/c1-9-8-12(17-10(2)22)23-13(9)14-18-19-16-21(14)20-15(24-16)11-6-4-3-5-7-11/h3-8H,1-2H3,(H,17,22)
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n/an/a 42n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218377
PNG
(CHEMBL442239 | N1-[5-(4-amino-5-sulfanyl-4H-1,2,4-...)
Show SMILES Nn1c(n[nH]c1=S)-c1sc(NC(=O)CCl)cc1-c1ccccc1
Show InChI InChI=1S/C14H12ClN5OS2/c15-7-10(21)17-11-6-9(8-4-2-1-3-5-8)12(23-11)13-18-19-14(22)20(13)16/h1-6H,7,16H2,(H,17,21)(H,19,22)
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n/an/a 42n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218346
PNG
(CHEMBL394010 | N1-[5-(6,7-diphenyl-5H-[1,2,4]triaz...)
Show SMILES CC(=O)Nc1cc(C)c(s1)-c1nnc2SC(C(=Nn12)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H19N5OS2/c1-14-13-18(24-15(2)29)30-20(14)22-25-26-23-28(22)27-19(16-9-5-3-6-10-16)21(31-23)17-11-7-4-8-12-17/h3-13,21H,1-2H3,(H,24,29)
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n/an/a 44n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218370
PNG
(CHEMBL239205 | N1-[5-(4-amino-5-sulfanyl-4H-1,2,4-...)
Show SMILES Cc1cc(NC(=O)CCl)sc1-c1n[nH]c(=S)n1N
Show InChI InChI=1S/C9H10ClN5OS2/c1-4-2-6(12-5(16)3-10)18-7(4)8-13-14-9(17)15(8)11/h2H,3,11H2,1H3,(H,12,16)(H,14,17)
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n/an/a 46n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218341
PNG
(CHEMBL237857 | N1-4-phenyl-5-[6-(3-nitrophenyl)-5,...)
Show SMILES [O-][N+](=O)c1cccc(c1)-c1nn2c(nnc2s1)-c1sc(NC(=O)CCl)cc1-c1ccccc1
Show InChI InChI=1S/C21H13ClN6O3S2/c22-11-16(29)23-17-10-15(12-5-2-1-3-6-12)18(32-17)19-24-25-21-27(19)26-20(33-21)13-7-4-8-14(9-13)28(30)31/h1-10H,11H2,(H,23,29)
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n/an/a 48n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218338
PNG
(CHEMBL235967 | N1-4-methyl-5-[6-(3-nitrophenyl)-5,...)
Show SMILES Cc1cc(NC(=O)CCl)sc1-c1nnc2sc(nn12)-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C16H11ClN6O3S2/c1-8-5-12(18-11(24)7-17)27-13(8)14-19-20-16-22(14)21-15(28-16)9-3-2-4-10(6-9)23(25)26/h2-6H,7H2,1H3,(H,18,24)
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n/an/a 53n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218342
PNG
(CHEMBL239215 | N1-[4-phenyl-5-(5H-[1,2,4]triazolo[...)
Show SMILES CC(=O)Nc1cc(c(s1)-c1nnc2Sc3nc4ccccc4nc3Nn12)-c1ccccc1
Show InChI InChI=1S/C22H15N7OS2/c1-12(30)23-17-11-14(13-7-3-2-4-8-13)18(31-17)20-26-27-22-29(20)28-19-21(32-22)25-16-10-6-5-9-15(16)24-19/h2-11H,1H3,(H,23,30)(H,24,28)
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n/an/a 54n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218348
PNG
(CHEMBL235972 | N1-[5-(4-amino-5-sulfanyl-4H-1,2,4-...)
Show SMILES CC(=O)Nc1cc(c(s1)-c1n[nH]c(=S)n1N)-c1ccccc1
Show InChI InChI=1S/C14H13N5OS2/c1-8(20)16-11-7-10(9-5-3-2-4-6-9)12(22-11)13-17-18-14(21)19(13)15/h2-7H,15H2,1H3,(H,16,20)(H,18,21)
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n/an/a 54n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218350
PNG
(CHEMBL239203 | N1-[5-(4-amino-5-sulfanyl-4H-1,2,4-...)
Show SMILES CC(=O)Nc1cc(C)c(s1)-c1n[nH]c(=S)n1N
Show InChI InChI=1S/C9H11N5OS2/c1-4-3-6(11-5(2)15)17-7(4)8-12-13-9(16)14(8)10/h3H,10H2,1-2H3,(H,11,15)(H,13,16)
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n/an/a 58n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218351
PNG
(CHEMBL237856 | N1-4-phenyl-5-[6-(3-nitrophenyl)-5,...)
Show SMILES CC(=O)Nc1cc(c(s1)-c1nnc2sc(nn12)-c1cccc(c1)[N+]([O-])=O)-c1ccccc1
Show InChI InChI=1S/C21H14N6O3S2/c1-12(28)22-17-11-16(13-6-3-2-4-7-13)18(31-17)19-23-24-21-26(19)25-20(32-21)14-8-5-9-15(10-14)27(29)30/h2-11H,1H3,(H,22,28)
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n/an/a 60n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218333
PNG
(CHEMBL239856 | N1-[5-(6,7-diphenyl-5H-[1,2,4]triaz...)
Show SMILES ClCC(=O)Nc1cc(c(s1)-c1nnc2SC(C(=Nn12)c1ccccc1)c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C28H20ClN5OS2/c29-17-22(35)30-23-16-21(18-10-4-1-5-11-18)26(36-23)27-31-32-28-34(27)33-24(19-12-6-2-7-13-19)25(37-28)20-14-8-3-9-15-20/h1-16,25H,17H2,(H,30,35)
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n/an/a 62n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218334
PNG
(CHEMBL235965 | N1-4-methyl-5-[6-(3-nitrophenyl)-5,...)
Show SMILES CC(=O)Nc1cc(C)c(s1)-c1nnc2sc(nn12)-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C16H12N6O3S2/c1-8-6-12(17-9(2)23)26-13(8)14-18-19-16-21(14)20-15(27-16)10-4-3-5-11(7-10)22(24)25/h3-7H,1-2H3,(H,17,23)
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n/an/a 64n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218361
PNG
(CHEMBL238997 | N1-[4-methyl-5-(5H-[1,2,4]triazolo[...)
Show SMILES Cc1cc(NC(=O)CCl)sc1-c1nnc2Sc3nc4ccccc4nc3Nn12
Show InChI InChI=1S/C17H12ClN7OS2/c1-8-6-12(21-11(26)7-18)27-13(8)15-22-23-17-25(15)24-14-16(28-17)20-10-5-3-2-4-9(10)19-14/h2-6H,7H2,1H3,(H,19,24)(H,21,26)
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n/an/a 64n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218359
PNG
(CHEMBL238576 | N1-[5-(6,7-diphenyl-5H-[1,2,4]triaz...)
Show SMILES Cc1cc(NC(=O)CCl)sc1-c1nnc2SC(C(=Nn12)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H18ClN5OS2/c1-14-12-18(25-17(30)13-24)31-20(14)22-26-27-23-29(22)28-19(15-8-4-2-5-9-15)21(32-23)16-10-6-3-7-11-16/h2-12,21H,13H2,1H3,(H,25,30)
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n/an/a 72n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218339
PNG
(CHEMBL391314 | N1-[4-phenyl-5-(6-methyl-7H-[1,2,4]...)
Show SMILES CC1=Nn2c(SC1)nnc2-c1sc(NC(=O)CCl)cc1-c1ccccc1
Show InChI InChI=1S/C17H14ClN5OS2/c1-10-9-25-17-21-20-16(23(17)22-10)15-12(11-5-3-2-4-6-11)7-14(26-15)19-13(24)8-18/h2-7H,8-9H2,1H3,(H,19,24)
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n/an/a 368n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218340
PNG
(CHEMBL391723 | N1-[4-phenyl-5-(6-oxo-6,7-dihydro-5...)
Show SMILES CC(=O)Nc1cc(c(s1)-c1nnc2SCC(=O)Nn12)-c1ccccc1
Show InChI InChI=1S/C16H13N5O2S2/c1-9(22)17-13-7-11(10-5-3-2-4-6-10)14(25-13)15-18-19-16-21(15)20-12(23)8-24-16/h2-7H,8H2,1H3,(H,17,22)(H,20,23)
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n/an/a 418n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218352
PNG
(CHEMBL238267 | N1-[4-phenyl-5-(6-methyl-7H-[1,2,4]...)
Show SMILES CC(=O)Nc1cc(c(s1)-c1nnc2SCC(C)=Nn12)-c1ccccc1
Show InChI InChI=1S/C17H15N5OS2/c1-10-9-24-17-20-19-16(22(17)21-10)15-13(12-6-4-3-5-7-12)8-14(25-15)18-11(2)23/h3-8H,9H2,1-2H3,(H,18,23)
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n/an/a 448n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218374
PNG
(CHEMBL238575 | N1-[4-methyl-5-(6-methyl-7H-[1,2,4]...)
Show SMILES Cc1cc(NC(=O)CCl)sc1-c1nnc2SCC(C)=Nn12
Show InChI InChI=1S/C12H12ClN5OS2/c1-6-3-9(14-8(19)4-13)21-10(6)11-15-16-12-18(11)17-7(2)5-20-12/h3H,4-5H2,1-2H3,(H,14,19)
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n/an/a 462n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218362
PNG
(CHEMBL239853 | N1-[4-methyl-5-(6-oxo-6,7-dihydro-5...)
Show SMILES CC(=O)Nc1cc(C)c(s1)-c1nnc2SCC(=O)Nn12
Show InChI InChI=1S/C11H11N5O2S2/c1-5-3-8(12-6(2)17)20-9(5)10-13-14-11-16(10)15-7(18)4-19-11/h3H,4H2,1-2H3,(H,12,17)(H,15,18)
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n/an/a 630n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218375
PNG
(CHEMBL238116 | N1-[4-phenyl-5-(6-oxo-6,7-dihydro-5...)
Show SMILES ClCC(=O)Nc1cc(c(s1)-c1nnc2SCC(=O)Nn12)-c1ccccc1
Show InChI InChI=1S/C16H12ClN5O2S2/c17-7-11(23)18-13-6-10(9-4-2-1-3-5-9)14(26-13)15-19-20-16-22(15)21-12(24)8-25-16/h1-6H,7-8H2,(H,18,23)(H,21,24)
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n/an/a 634n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218335
PNG
(CHEMBL241764 | N1-[4-methyl-5-(6-methyl-7H-[1,2,4]...)
Show SMILES CC(=O)Nc1cc(C)c(s1)-c1nnc2SCC(C)=Nn12
Show InChI InChI=1S/C12H13N5OS2/c1-6-4-9(13-8(3)18)20-10(6)11-14-15-12-17(11)16-7(2)5-19-12/h4H,5H2,1-3H3,(H,13,18)
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n/an/a 642n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218344
PNG
(CHEMBL239637 | N1-[4-methyl-5-(6-oxo-6,7-dihydro-5...)
Show SMILES Cc1cc(NC(=O)CCl)sc1-c1nnc2SCC(=O)Nn12
Show InChI InChI=1S/C11H10ClN5O2S2/c1-5-2-8(13-6(18)3-12)21-9(5)10-14-15-11-17(10)16-7(19)4-20-11/h2H,3-4H2,1H3,(H,13,18)(H,16,19)
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n/an/a 820n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218380
PNG
(CHEMBL236102 | N1-(5-6-(2,4-dichloro-5-fluoropheny...)
Show SMILES CC(=O)Nc1cc(c(s1)-c1nnc2S\C(=C/c3ccccc3)C(=Nn12)c1cc(F)c(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C29H18Cl2FN5OS2/c1-16(38)33-25-14-19(18-10-6-3-7-11-18)27(40-25)28-34-35-29-37(28)36-26(20-13-23(32)22(31)15-21(20)30)24(39-29)12-17-8-4-2-5-9-17/h2-15H,1H3,(H,33,38)/b24-12-
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n/an/a 1.45E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218355
PNG
(CHEMBL237659 | N1-[4-phenyl-5-(6-thioxo-5,6-dihydr...)
Show SMILES CC(=O)Nc1cc(c(s1)-c1nnc2sc(S)nn12)-c1ccccc1
Show InChI InChI=1S/C15H11N5OS3/c1-8(21)16-11-7-10(9-5-3-2-4-6-9)12(23-11)13-17-18-14-20(13)19-15(22)24-14/h2-7H,1H3,(H,16,21)(H,19,22)
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n/an/a 2.06E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50411427
PNG
(CHEMBL1162016)
Show SMILES CC(=O)Nc1cc(C)c(s1)-c1nnc2S\C(=C/c3ccccc3)C(=Nn12)c1cc(F)c(Cl)cc1Cl
Show InChI InChI=1S/C24H16Cl2FN5OS2/c1-12-8-20(28-13(2)33)35-22(12)23-29-30-24-32(23)31-21(15-10-18(27)17(26)11-16(15)25)19(34-24)9-14-6-4-3-5-7-14/h3-11H,1-2H3,(H,28,33)/b19-9-
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n/an/a 2.37E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218366
PNG
(CHEMBL394958 | N1-(5-6-(2,4-dichloro-5-fluoropheny...)
Show SMILES CC(=O)Nc1cc(c(s1)-c1nnc2sc([CH-]c3cccc(c3)[N+]([O-])=O)c(n[n+]12)-c1cc(F)c(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C29H17Cl2FN6O3S2/c1-15(39)33-25-13-19(17-7-3-2-4-8-17)27(43-25)28-34-35-29-37(28)36-26(20-12-23(32)22(31)14-21(20)30)24(42-29)11-16-6-5-9-18(10-16)38(40)41/h2-14H,1H3,(H,33,39)
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n/an/a 2.44E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218364
PNG
(CHEMBL235660 | N1-{5-[7-[(Z)-1-(4-chlorophenyl)met...)
Show SMILES Fc1cc(C2=Nn3c(S\C2=C/c2ccc(Cl)cc2)nnc3-c2sc(NC(=O)CCl)cc2-c2ccccc2)c(Cl)cc1Cl
Show InChI InChI=1S/C29H16Cl4FN5OS2/c30-14-24(40)35-25-12-18(16-4-2-1-3-5-16)27(42-25)28-36-37-29-39(28)38-26(19-11-22(34)21(33)13-20(19)32)23(41-29)10-15-6-8-17(31)9-7-15/h1-13H,14H2,(H,35,40)/b23-10-
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n/an/a 2.45E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218371
PNG
(CHEMBL394452 | N1-{5-[7-[(Z)-1-(2-chlorophenyl)met...)
Show SMILES Fc1cc(C2=Nn3c(S\C2=C/c2ccccc2Cl)nnc3-c2sc(NC(=O)CCl)cc2-c2ccccc2)c(Cl)cc1Cl
Show InChI InChI=1S/C29H16Cl4FN5OS2/c30-14-24(40)35-25-12-17(15-6-2-1-3-7-15)27(42-25)28-36-37-29-39(28)38-26(18-11-22(34)21(33)13-20(18)32)23(41-29)10-16-8-4-5-9-19(16)31/h1-13H,14H2,(H,35,40)/b23-10-
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n/an/a 2.46E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218378
PNG
(CHEMBL435355 | N1-{5-[7-[(Z)-1-(2-chlorophenyl)met...)
Show SMILES CC(=O)Nc1cc(c(s1)-c1nnc2S\C(=C/c3ccccc3Cl)C(=Nn12)c1cc(F)c(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C29H17Cl3FN5OS2/c1-15(39)34-25-13-18(16-7-3-2-4-8-16)27(41-25)28-35-36-29-38(28)37-26(19-12-23(33)22(32)14-21(19)31)24(40-29)11-17-9-5-6-10-20(17)30/h2-14H,1H3,(H,34,39)/b24-11-
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n/an/a 2.46E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218343
PNG
(CHEMBL414698 | N1-{5-[7-[(Z)-1-(4-chlorophenyl)met...)
Show SMILES CC(=O)Nc1cc(c(s1)-c1nnc2S\C(=C/c3ccc(Cl)cc3)C(=Nn12)c1cc(F)c(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C29H17Cl3FN5OS2/c1-15(39)34-25-13-19(17-5-3-2-4-6-17)27(41-25)28-35-36-29-38(28)37-26(20-12-23(33)22(32)14-21(20)31)24(40-29)11-16-7-9-18(30)10-8-16/h2-14H,1H3,(H,34,39)/b24-11-
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n/an/a 2.48E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218373
PNG
(CHEMBL394451 | N1-(5-6-(2,4-dichloro-5-fluoropheny...)
Show SMILES Fc1cc(C2=Nn3c(S\C2=C/c2ccccc2)nnc3-c2sc(NC(=O)CCl)cc2-c2ccccc2)c(Cl)cc1Cl
Show InChI InChI=1S/C29H17Cl3FN5OS2/c30-15-24(39)34-25-13-18(17-9-5-2-6-10-17)27(41-25)28-35-36-29-38(28)37-26(19-12-22(33)21(32)14-20(19)31)23(40-29)11-16-7-3-1-4-8-16/h1-14H,15H2,(H,34,39)/b23-11-
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n/an/a 2.49E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218363
PNG
(CHEMBL394959 | N1-(5-6-(2,4-dichloro-5-fluoropheny...)
Show SMILES [O-][N+](=O)c1cccc([CH-]c2sc3nnc(-c4sc(NC(=O)CCl)cc4-c4ccccc4)[n+]3nc2-c2cc(F)c(Cl)cc2Cl)c1
Show InChI InChI=1S/C29H16Cl3FN6O3S2/c30-14-24(40)34-25-12-18(16-6-2-1-3-7-16)27(44-25)28-35-36-29-38(28)37-26(19-11-22(33)21(32)13-20(19)31)23(43-29)10-15-5-4-8-17(9-15)39(41)42/h1-13H,14H2,(H,34,40)
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n/an/a 2.68E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218336
PNG
(CHEMBL235886 | N1-{5-[7-[(Z)-1-(4-chlorophenyl)met...)
Show SMILES Cc1cc(NC(=O)CCl)sc1-c1nnc2S\C(=C/c3ccc(Cl)cc3)C(=Nn12)c1cc(F)c(Cl)cc1Cl
Show InChI InChI=1S/C24H14Cl4FN5OS2/c1-11-6-20(30-19(35)10-25)37-22(11)23-31-32-24-34(23)33-21(14-8-17(29)16(28)9-15(14)27)18(36-24)7-12-2-4-13(26)5-3-12/h2-9H,10H2,1H3,(H,30,35)/b18-7-
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n/an/a 2.97E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218347
PNG
(CHEMBL235887 | N1-(5-6-(2,4-dichloro-5-fluoropheny...)
Show SMILES CC(=O)Nc1cc(C)c(s1)-c1nnc2sc([CH-]c3cccc(c3)[N+]([O-])=O)c(n[n+]12)-c1cc(F)c(Cl)cc1Cl
Show InChI InChI=1S/C24H15Cl2FN6O3S2/c1-11-6-20(28-12(2)34)38-22(11)23-29-30-24-32(23)31-21(15-9-18(27)17(26)10-16(15)25)19(37-24)8-13-4-3-5-14(7-13)33(35)36/h3-10H,1-2H3,(H,28,34)
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n/an/a 3.05E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218368
PNG
(CHEMBL392317 | N1-(5-6-(2,4-dichloro-5-fluoropheny...)
Show SMILES Cc1cc(NC(=O)CCl)sc1-c1nnc2sc([CH-]c3cccc(c3)[N+]([O-])=O)c(n[n+]12)-c1cc(F)c(Cl)cc1Cl
Show InChI InChI=1S/C24H14Cl3FN6O3S2/c1-11-5-20(29-19(35)10-25)39-22(11)23-30-31-24-33(23)32-21(14-8-17(28)16(27)9-15(14)26)18(38-24)7-12-3-2-4-13(6-12)34(36)37/h2-9H,10H2,1H3,(H,29,35)
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n/an/a 3.07E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218345
PNG
(CHEMBL238999 | N1-[4-methyl-5-(6-thioxo-5,6-dihydr...)
Show SMILES CC(=O)Nc1cc(C)c(s1)-c1nnc2sc(S)nn12
Show InChI InChI=1S/C10H9N5OS3/c1-4-3-6(11-5(2)16)18-7(4)8-12-13-9-15(8)14-10(17)19-9/h3H,1-2H3,(H,11,16)(H,14,17)
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n/an/a 3.26E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218353
PNG
(CHEMBL235670 | N1-{5-[7-[(Z)-1-(2-chlorophenyl)met...)
Show SMILES CC(=O)Nc1cc(C)c(s1)-c1nnc2S\C(=C/c3ccccc3Cl)C(=Nn12)c1cc(F)c(Cl)cc1Cl
Show InChI InChI=1S/C24H15Cl3FN5OS2/c1-11-7-20(29-12(2)34)36-22(11)23-30-31-24-33(23)32-21(14-9-18(28)17(27)10-16(14)26)19(35-24)8-13-5-3-4-6-15(13)25/h3-10H,1-2H3,(H,29,34)/b19-8-
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n/an/a 3.28E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218365
PNG
(CHEMBL391666 | N1-{5-[7-[(Z)-1-(2-chlorophenyl)met...)
Show SMILES Cc1cc(NC(=O)CCl)sc1-c1nnc2S\C(=C/c3ccccc3Cl)C(=Nn12)c1cc(F)c(Cl)cc1Cl
Show InChI InChI=1S/C24H14Cl4FN5OS2/c1-11-6-20(30-19(35)10-25)37-22(11)23-31-32-24-34(23)33-21(13-8-17(29)16(28)9-15(13)27)18(36-24)7-12-4-2-3-5-14(12)26/h2-9H,10H2,1H3,(H,30,35)/b18-7-
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n/an/a 3.34E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218376
PNG
(CHEMBL235671 | N1-{5-[7-[(Z)-1-(4-chlorophenyl)met...)
Show SMILES CC(=O)Nc1cc(C)c(s1)-c1nnc2S\C(=C/c3ccc(Cl)cc3)C(=Nn12)c1cc(F)c(Cl)cc1Cl
Show InChI InChI=1S/C24H15Cl3FN5OS2/c1-11-7-20(29-12(2)34)36-22(11)23-30-31-24-33(23)32-21(15-9-18(28)17(27)10-16(15)26)19(35-24)8-13-3-5-14(25)6-4-13/h3-10H,1-2H3,(H,29,34)/b19-8-
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n/an/a 3.39E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50411426
PNG
(CHEMBL1162017)
Show SMILES Cc1cc(NC(=O)CCl)sc1-c1nnc2S\C(=C/c3ccccc3)C(=Nn12)c1cc(F)c(Cl)cc1Cl
Show InChI InChI=1S/C24H15Cl3FN5OS2/c1-12-7-20(29-19(34)11-25)36-22(12)23-30-31-24-33(23)32-21(14-9-17(28)16(27)10-15(14)26)18(35-24)8-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,29,34)/b18-8-
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n/an/a 3.42E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218360
PNG
(CHEMBL396649 | N1-[4-phenyl-5-(6-thioxo-5,6-dihydr...)
Show SMILES Sc1nn2c(nnc2s1)-c1sc(NC(=O)CCl)cc1-c1ccccc1
Show InChI InChI=1S/C15H10ClN5OS3/c16-7-10(22)17-11-6-9(8-4-2-1-3-5-8)12(24-11)13-18-19-14-21(13)20-15(23)25-14/h1-6H,7H2,(H,17,22)(H,20,23)
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n/an/a 5.90E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50218367
PNG
(CHEMBL239213 | N1-[4-methyl-5-(6-thioxo-5,6-dihydr...)
Show SMILES Cc1cc(NC(=O)CCl)sc1-c1nnc2sc(S)nn12
Show InChI InChI=1S/C10H8ClN5OS3/c1-4-2-6(12-5(17)3-11)19-7(4)8-13-14-9-16(8)15-10(18)20-9/h2H,3H2,1H3,(H,12,17)(H,15,18)
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n/an/a 7.48E+3n/an/an/an/an/an/a



Dr. Reddy's Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Cdk5/p25


Bioorg Med Chem 15: 6397-406 (2007)


Article DOI: 10.1016/j.bmc.2007.06.053
BindingDB Entry DOI: 10.7270/Q2JS9RP0
More data for this
Ligand-Target Pair