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PubMed code 23083119

Compile data set for download or QSAR
Found 57 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 5 (CDK5)


(Homo sapiens (human))
BDBM50399310
PNG
(CHEMBL2180854)
Show SMILES Brc1ccnc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)c1
Show InChI InChI=1S/C18H17BrN4O2/c19-11-7-8-20-15(10-11)22-18(25)21-13-5-3-4-12-16(13)14-6-1-2-9-23(14)17(12)24/h3-5,7-8,10,14H,1-2,6,9H2,(H2,20,21,22,25)
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n/an/a 25n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399303
PNG
(CHEMBL2180844)
Show SMILES Oc1cccnc1NC(=O)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C18H18N4O3/c23-14-8-4-9-19-16(14)21-18(25)20-12-6-3-5-11-15(12)13-7-1-2-10-22(13)17(11)24/h3-6,8-9,13,23H,1-2,7,10H2,(H2,19,20,21,25)
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n/an/a 37n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399312
PNG
(CHEMBL2180852)
Show SMILES Brc1cccc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)n1
Show InChI InChI=1S/C18H17BrN4O2/c19-14-8-4-9-15(21-14)22-18(25)20-12-6-3-5-11-16(12)13-7-1-2-10-23(13)17(11)24/h3-6,8-9,13H,1-2,7,10H2,(H2,20,21,22,25)
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n/an/a 40n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399315
PNG
(CHEMBL2180849)
Show SMILES O=C(Nc1cc2ccccc2cn1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C22H20N4O2/c27-21-16-8-5-9-17(20(16)18-10-3-4-11-26(18)21)24-22(28)25-19-12-14-6-1-2-7-15(14)13-23-19/h1-2,5-9,12-13,18H,3-4,10-11H2,(H2,23,24,25,28)
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n/an/a 68n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399326
PNG
(CHEMBL2180863)
Show SMILES O=C(Nc1cnccn1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C17H17N5O2/c23-16-11-4-3-5-12(15(11)13-6-1-2-9-22(13)16)20-17(24)21-14-10-18-7-8-19-14/h3-5,7-8,10,13H,1-2,6,9H2,(H2,19,20,21,24)
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n/an/a 70n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (human))
BDBM50399301
PNG
(CHEMBL2180862)
Show SMILES O=C(Nc1ccccn1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C18H18N4O2/c23-17-12-6-5-7-13(16(12)14-8-2-4-11-22(14)17)20-18(24)21-15-9-1-3-10-19-15/h1,3,5-7,9-10,14H,2,4,8,11H2,(H2,19,20,21,24)
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n/an/a 75n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of CDK1


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399301
PNG
(CHEMBL2180862)
Show SMILES O=C(Nc1ccccn1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C18H18N4O2/c23-17-12-6-5-7-13(16(12)14-8-2-4-11-22(14)17)20-18(24)21-15-9-1-3-10-19-15/h1,3,5-7,9-10,14H,2,4,8,11H2,(H2,19,20,21,24)
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n/an/a 80n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399309
PNG
(CHEMBL2180855)
Show SMILES Fc1cccc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)n1
Show InChI InChI=1S/C18H17FN4O2/c19-14-8-4-9-15(21-14)22-18(25)20-12-6-3-5-11-16(12)13-7-1-2-10-23(13)17(11)24/h3-6,8-9,13H,1-2,7,10H2,(H2,20,21,22,25)
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n/an/a 90n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399311
PNG
(CHEMBL2180853)
Show SMILES Brc1ccc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)nc1
Show InChI InChI=1S/C18H17BrN4O2/c19-11-7-8-15(20-10-11)22-18(25)21-13-5-3-4-12-16(13)14-6-1-2-9-23(14)17(12)24/h3-5,7-8,10,14H,1-2,6,9H2,(H2,20,21,22,25)
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n/an/a 130n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399320
PNG
(CHEMBL2180869)
Show SMILES O=C(Nc1ccn[nH]1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C16H17N5O2/c22-15-10-4-3-5-11(14(10)12-6-1-2-9-21(12)15)18-16(23)19-13-7-8-17-20-13/h3-5,7-8,12H,1-2,6,9H2,(H3,17,18,19,20,23)
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n/an/a 170n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399308
PNG
(CHEMBL2180856)
Show SMILES Fc1cnc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)c(F)c1
Show InChI InChI=1S/C18H16F2N4O2/c19-10-8-12(20)16(21-9-10)23-18(26)22-13-5-3-4-11-15(13)14-6-1-2-7-24(14)17(11)25/h3-5,8-9,14H,1-2,6-7H2,(H2,21,22,23,26)
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n/an/a 260n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399323
PNG
(CHEMBL2180866)
Show SMILES O=C(Nc1cscn1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C16H16N4O2S/c21-15-10-4-3-5-11(14(10)12-6-1-2-7-20(12)15)18-16(22)19-13-8-23-9-17-13/h3-5,8-9,12H,1-2,6-7H2,(H2,18,19,22)
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n/an/a 430n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399319
PNG
(CHEMBL2180870)
Show SMILES Cn1ccc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)n1
Show InChI InChI=1S/C17H19N5O2/c1-21-10-8-14(20-21)19-17(24)18-12-6-4-5-11-15(12)13-7-2-3-9-22(13)16(11)23/h4-6,8,10,13H,2-3,7,9H2,1H3,(H2,18,19,20,24)
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n/an/a 510n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399322
PNG
(CHEMBL2180867)
Show SMILES Cc1nc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)cs1
Show InChI InChI=1S/C17H18N4O2S/c1-10-18-14(9-24-10)20-17(23)19-12-6-4-5-11-15(12)13-7-2-3-8-21(13)16(11)22/h4-6,9,13H,2-3,7-8H2,1H3,(H2,19,20,23)
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n/an/a 530n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399306
PNG
(CHEMBL2180858)
Show SMILES COc1cccnc1NC(=O)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C19H20N4O3/c1-26-15-9-5-10-20-17(15)22-19(25)21-13-7-4-6-12-16(13)14-8-2-3-11-23(14)18(12)24/h4-7,9-10,14H,2-3,8,11H2,1H3,(H2,20,21,22,25)
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n/an/a 590n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399314
PNG
(CHEMBL2180850)
Show SMILES Oc1cccc2ccc(NC(=O)Nc3cccc4C(=O)N5CCCCC5c34)nc12
Show InChI InChI=1S/C22H20N4O3/c27-17-9-3-5-13-10-11-18(24-20(13)17)25-22(29)23-15-7-4-6-14-19(15)16-8-1-2-12-26(16)21(14)28/h3-7,9-11,16,27H,1-2,8,12H2,(H2,23,24,25,29)
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n/an/a 700n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399302
PNG
(CHEMBL2180845)
Show SMILES Oc1ccc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)nc1
Show InChI InChI=1S/C18H18N4O3/c23-11-7-8-15(19-10-11)21-18(25)20-13-5-3-4-12-16(13)14-6-1-2-9-22(14)17(12)24/h3-5,7-8,10,14,23H,1-2,6,9H2,(H2,19,20,21,25)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399317
PNG
(CHEMBL2180847)
Show SMILES O=C(Nc1cc(on1)-c1ccccc1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C22H20N4O3/c27-21-15-9-6-10-16(20(15)17-11-4-5-12-26(17)21)23-22(28)24-19-13-18(29-25-19)14-7-2-1-3-8-14/h1-3,6-10,13,17H,4-5,11-12H2,(H2,23,24,25,28)
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n/an/a 1.50E+3n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399324
PNG
(CHEMBL2180865)
Show SMILES O=C(Nc1ccncn1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C17H17N5O2/c23-16-11-4-3-5-12(15(11)13-6-1-2-9-22(13)16)20-17(24)21-14-7-8-18-10-19-14/h3-5,7-8,10,13H,1-2,6,9H2,(H2,18,19,20,21,24)
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n/an/a 1.50E+3n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399321
PNG
(CHEMBL2180868)
Show SMILES O=C(Nc1csc(n1)-c1ccncc1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C21H19N5O2S/c27-20-14-4-3-5-15(18(14)16-6-1-2-11-26(16)20)23-21(28)25-17-12-29-19(24-17)13-7-9-22-10-8-13/h3-5,7-10,12,16H,1-2,6,11H2,(H2,23,25,28)
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n/an/a 1.70E+3n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399303
PNG
(CHEMBL2180844)
Show SMILES Oc1cccnc1NC(=O)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C18H18N4O3/c23-14-8-4-9-19-16(14)21-18(25)20-12-6-3-5-11-15(12)13-7-1-2-10-22(13)17(11)24/h3-6,8-9,13,23H,1-2,7,10H2,(H2,19,20,21,25)
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n/an/a 1.80E+3n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399321
PNG
(CHEMBL2180868)
Show SMILES O=C(Nc1csc(n1)-c1ccncc1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C21H19N5O2S/c27-20-14-4-3-5-15(18(14)16-6-1-2-11-26(16)20)23-21(28)25-17-12-29-19(24-17)13-7-9-22-10-8-13/h3-5,7-10,12,16H,1-2,6,11H2,(H2,23,25,28)
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n/an/a 2.40E+3n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399318
PNG
(CHEMBL2180846)
Show SMILES Cc1cc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)no1
Show InChI InChI=1S/C17H18N4O3/c1-10-9-14(20-24-10)19-17(23)18-12-6-4-5-11-15(12)13-7-2-3-8-21(13)16(11)22/h4-6,9,13H,2-3,7-8H2,1H3,(H2,18,19,20,23)
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n/an/a 2.70E+3n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399312
PNG
(CHEMBL2180852)
Show SMILES Brc1cccc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)n1
Show InChI InChI=1S/C18H17BrN4O2/c19-14-8-4-9-15(21-14)22-18(25)20-12-6-3-5-11-16(12)13-7-1-2-10-23(13)17(11)24/h3-6,8-9,13H,1-2,7,10H2,(H2,20,21,22,25)
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n/an/a 3.40E+3n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399309
PNG
(CHEMBL2180855)
Show SMILES Fc1cccc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)n1
Show InChI InChI=1S/C18H17FN4O2/c19-14-8-4-9-15(21-14)22-18(25)20-12-6-3-5-11-16(12)13-7-1-2-10-23(13)17(11)24/h3-6,8-9,13H,1-2,7,10H2,(H2,20,21,22,25)
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n/an/a 3.50E+3n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399304
PNG
(CHEMBL2180843)
Show SMILES O=C(Nc1ccc(cn1)-c1ccccc1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C24H22N4O2/c29-23-18-9-6-10-19(22(18)20-11-4-5-14-28(20)23)26-24(30)27-21-13-12-17(15-25-21)16-7-2-1-3-8-16/h1-3,6-10,12-13,15,20H,4-5,11,14H2,(H2,25,26,27,30)
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n/an/a 4.00E+3n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399313
PNG
(CHEMBL2180851)
Show SMILES Oc1cc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)nc2ccccc12
Show InChI InChI=1S/C22H20N4O3/c27-18-12-19(23-15-8-2-1-6-13(15)18)25-22(29)24-16-9-5-7-14-20(16)17-10-3-4-11-26(17)21(14)28/h1-2,5-9,12,17H,3-4,10-11H2,(H3,23,24,25,27,29)
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n/an/a 5.60E+3n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399310
PNG
(CHEMBL2180854)
Show SMILES Brc1ccnc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)c1
Show InChI InChI=1S/C18H17BrN4O2/c19-11-7-8-20-15(10-11)22-18(25)21-13-5-3-4-12-16(13)14-6-1-2-9-23(14)17(12)24/h3-5,7-8,10,14H,1-2,6,9H2,(H2,20,21,22,25)
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n/an/a 7.60E+3n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399306
PNG
(CHEMBL2180858)
Show SMILES COc1cccnc1NC(=O)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C19H20N4O3/c1-26-15-9-5-10-20-17(15)22-19(25)21-13-7-4-6-12-16(13)14-8-2-3-11-23(14)18(12)24/h4-7,9-10,14H,2-3,8,11H2,1H3,(H2,20,21,22,25)
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n/an/a 8.10E+3n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399327
PNG
(CHEMBL2180861)
Show SMILES O=C(Nc1ccccc1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C19H19N3O2/c23-18-14-9-6-10-15(17(14)16-11-4-5-12-22(16)18)21-19(24)20-13-7-2-1-3-8-13/h1-3,6-10,16H,4-5,11-12H2,(H2,20,21,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399318
PNG
(CHEMBL2180846)
Show SMILES Cc1cc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)no1
Show InChI InChI=1S/C17H18N4O3/c1-10-9-14(20-24-10)19-17(23)18-12-6-4-5-11-15(12)13-7-2-3-8-21(13)16(11)22/h4-6,9,13H,2-3,7-8H2,1H3,(H2,18,19,20,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399315
PNG
(CHEMBL2180849)
Show SMILES O=C(Nc1cc2ccccc2cn1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C22H20N4O2/c27-21-16-8-5-9-17(20(16)18-10-3-4-11-26(18)21)24-22(28)25-19-12-14-6-1-2-7-15(14)13-23-19/h1-2,5-9,12-13,18H,3-4,10-11H2,(H2,23,24,25,28)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399311
PNG
(CHEMBL2180853)
Show SMILES Brc1ccc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)nc1
Show InChI InChI=1S/C18H17BrN4O2/c19-11-7-8-15(20-10-11)22-18(25)21-13-5-3-4-12-16(13)14-6-1-2-9-23(14)17(12)24/h3-5,7-8,10,14H,1-2,6,9H2,(H2,20,21,22,25)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399328
PNG
(CHEMBL2180860)
Show SMILES O=C(NC1CCCCC1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C19H25N3O2/c23-18-14-9-6-10-15(17(14)16-11-4-5-12-22(16)18)21-19(24)20-13-7-2-1-3-8-13/h6,9-10,13,16H,1-5,7-8,11-12H2,(H2,20,21,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399304
PNG
(CHEMBL2180843)
Show SMILES O=C(Nc1ccc(cn1)-c1ccccc1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C24H22N4O2/c29-23-18-9-6-10-19(22(18)20-11-4-5-14-28(20)23)26-24(30)27-21-13-12-17(15-25-21)16-7-2-1-3-8-16/h1-3,6-10,12-13,15,20H,4-5,11,14H2,(H2,25,26,27,30)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399305
PNG
(CHEMBL2180859)
Show SMILES O=C(Nc1cccc(n1)N1CCCCC1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C23H27N5O2/c29-22-16-8-6-9-17(21(16)18-10-2-5-15-28(18)22)24-23(30)26-19-11-7-12-20(25-19)27-13-3-1-4-14-27/h6-9,11-12,18H,1-5,10,13-15H2,(H2,24,25,26,30)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399328
PNG
(CHEMBL2180860)
Show SMILES O=C(NC1CCCCC1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C19H25N3O2/c23-18-14-9-6-10-15(17(14)16-11-4-5-12-22(16)18)21-19(24)20-13-7-2-1-3-8-13/h6,9-10,13,16H,1-5,7-8,11-12H2,(H2,20,21,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399316
PNG
(CHEMBL2180848)
Show SMILES O=C(Nc1nc2ccccc2s1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C20H18N4O2S/c25-18-12-6-5-8-14(17(12)15-9-3-4-11-24(15)18)21-19(26)23-20-22-13-7-1-2-10-16(13)27-20/h1-2,5-8,10,15H,3-4,9,11H2,(H2,21,22,23,26)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399308
PNG
(CHEMBL2180856)
Show SMILES Fc1cnc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)c(F)c1
Show InChI InChI=1S/C18H16F2N4O2/c19-10-8-12(20)16(21-9-10)23-18(26)22-13-5-3-4-11-15(13)14-6-1-2-7-24(14)17(11)25/h3-5,8-9,14H,1-2,6-7H2,(H2,21,22,23,26)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399325
PNG
(CHEMBL2180864)
Show SMILES O=C(Nc1ncccn1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C17H17N5O2/c23-15-11-5-3-6-12(14(11)13-7-1-2-10-22(13)15)20-17(24)21-16-18-8-4-9-19-16/h3-6,8-9,13H,1-2,7,10H2,(H2,18,19,20,21,24)
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Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399319
PNG
(CHEMBL2180870)
Show SMILES Cn1ccc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)n1
Show InChI InChI=1S/C17H19N5O2/c1-21-10-8-14(20-21)19-17(24)18-12-6-4-5-11-15(12)13-7-2-3-9-22(13)16(11)23/h4-6,8,10,13H,2-3,7,9H2,1H3,(H2,18,19,20,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399302
PNG
(CHEMBL2180845)
Show SMILES Oc1ccc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)nc1
Show InChI InChI=1S/C18H18N4O3/c23-11-7-8-15(19-10-11)21-18(25)20-13-5-3-4-12-16(13)14-6-1-2-9-22(14)17(12)24/h3-5,7-8,10,14,23H,1-2,6,9H2,(H2,19,20,21,25)
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Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399325
PNG
(CHEMBL2180864)
Show SMILES O=C(Nc1ncccn1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C17H17N5O2/c23-15-11-5-3-6-12(14(11)13-7-1-2-10-22(13)15)20-17(24)21-16-18-8-4-9-19-16/h3-6,8-9,13H,1-2,7,10H2,(H2,18,19,20,21,24)
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Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399314
PNG
(CHEMBL2180850)
Show SMILES Oc1cccc2ccc(NC(=O)Nc3cccc4C(=O)N5CCCCC5c34)nc12
Show InChI InChI=1S/C22H20N4O3/c27-17-9-3-5-13-10-11-18(24-20(13)17)25-22(29)23-15-7-4-6-14-19(15)16-8-1-2-12-26(16)21(14)28/h3-7,9-11,16,27H,1-2,8,12H2,(H2,23,24,25,29)
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Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399307
PNG
(CHEMBL2180857)
Show SMILES Clc1nc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)c(Cl)c(Cl)c1Cl
Show InChI InChI=1S/C18H14Cl4N4O2/c19-12-13(20)15(22)24-16(14(12)21)25-18(28)23-9-5-3-4-8-11(9)10-6-1-2-7-26(10)17(8)27/h3-5,10H,1-2,6-7H2,(H2,23,24,25,28)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399305
PNG
(CHEMBL2180859)
Show SMILES O=C(Nc1cccc(n1)N1CCCCC1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C23H27N5O2/c29-22-16-8-6-9-17(21(16)18-10-2-5-15-28(18)22)24-23(30)26-19-11-7-12-20(25-19)27-13-3-1-4-14-27/h6-9,11-12,18H,1-5,10,13-15H2,(H2,24,25,26,30)
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Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399307
PNG
(CHEMBL2180857)
Show SMILES Clc1nc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)c(Cl)c(Cl)c1Cl
Show InChI InChI=1S/C18H14Cl4N4O2/c19-12-13(20)15(22)24-16(14(12)21)25-18(28)23-9-5-3-4-8-11(9)10-6-1-2-7-26(10)17(8)27/h3-5,10H,1-2,6-7H2,(H2,23,24,25,28)
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Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399327
PNG
(CHEMBL2180861)
Show SMILES O=C(Nc1ccccc1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C19H19N3O2/c23-18-14-9-6-10-15(17(14)16-11-4-5-12-22(16)18)21-19(24)20-13-7-2-1-3-8-13/h1-3,6-10,16H,4-5,11-12H2,(H2,20,21,24)
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Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399326
PNG
(CHEMBL2180863)
Show SMILES O=C(Nc1cnccn1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C17H17N5O2/c23-16-11-4-3-5-12(15(11)13-6-1-2-9-22(13)16)20-17(24)21-14-10-18-7-8-19-14/h3-5,7-8,10,13H,1-2,6,9H2,(H2,19,20,21,24)
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Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399313
PNG
(CHEMBL2180851)
Show SMILES Oc1cc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)nc2ccccc12
Show InChI InChI=1S/C22H20N4O3/c27-18-12-19(23-15-8-2-1-6-13(15)18)25-22(29)24-16-9-5-7-14-20(16)17-10-3-4-11-26(17)21(14)28/h1-2,5-9,12,17H,3-4,10-11H2,(H3,23,24,25,27,29)
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Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399324
PNG
(CHEMBL2180865)
Show SMILES O=C(Nc1ccncn1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C17H17N5O2/c23-16-11-4-3-5-12(15(11)13-6-1-2-9-22(13)16)20-17(24)21-14-7-8-18-10-19-14/h3-5,7-8,10,13H,1-2,6,9H2,(H2,18,19,20,21,24)
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Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399317
PNG
(CHEMBL2180847)
Show SMILES O=C(Nc1cc(on1)-c1ccccc1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C22H20N4O3/c27-21-15-9-6-10-16(20(15)17-11-4-5-12-26(17)21)23-22(28)24-19-13-18(29-25-19)14-7-2-1-3-8-14/h1-3,6-10,13,17H,4-5,11-12H2,(H2,23,24,25,28)
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Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399320
PNG
(CHEMBL2180869)
Show SMILES O=C(Nc1ccn[nH]1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C16H17N5O2/c22-15-10-4-3-5-11(14(10)12-6-1-2-9-21(12)15)18-16(23)19-13-7-8-17-20-13/h3-5,7-8,12H,1-2,6,9H2,(H3,17,18,19,20,23)
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Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399322
PNG
(CHEMBL2180867)
Show SMILES Cc1nc(NC(=O)Nc2cccc3C(=O)N4CCCCC4c23)cs1
Show InChI InChI=1S/C17H18N4O2S/c1-10-18-14(9-24-10)20-17(23)19-12-6-4-5-11-15(12)13-7-2-3-8-21(13)16(11)22/h4-6,9,13H,2-3,7-8H2,1H3,(H2,19,20,23)
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Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399323
PNG
(CHEMBL2180866)
Show SMILES O=C(Nc1cscn1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C16H16N4O2S/c21-15-10-4-3-5-11(14(10)12-6-1-2-7-20(12)15)18-16(22)19-13-8-23-9-17-13/h3-5,8-9,12H,1-2,6-7H2,(H2,18,19,22)
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Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (human))
BDBM50399301
PNG
(CHEMBL2180862)
Show SMILES O=C(Nc1ccccn1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C18H18N4O2/c23-17-12-6-5-7-13(16(12)14-8-2-4-11-22(14)17)20-18(24)21-15-9-1-3-10-19-15/h1,3,5-7,9-10,14H,2,4,8,11H2,(H2,19,20,21,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused DYRK1A expressed in Escherichia coli using KKISGRLSPIMTEQ as substrate and [gamma-33P]-ATP after 30 mins by...


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5)


(Homo sapiens (human))
BDBM50399316
PNG
(CHEMBL2180848)
Show SMILES O=C(Nc1nc2ccccc2s1)Nc1cccc2C(=O)N3CCCCC3c12
Show InChI InChI=1S/C20H18N4O2S/c25-18-12-6-5-8-14(17(12)15-9-3-4-11-24(15)18)21-19(26)23-20-22-13-7-1-2-10-16(13)27-20/h1-2,5-8,10,15H,3-4,9,11H2,(H2,21,22,23,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.60E+4n/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 as substrate and [gamma-33P]-ATP after 30 mins by scintillation counting


J Med Chem 55: 9589-606 (2012)


Article DOI: 10.1021/jm3008536
BindingDB Entry DOI: 10.7270/Q28S4R2J
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%