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Compile Data Set for Download or QSAR

Found 123 hits Enz. Inhib. hit(s) with all data for entry = 50005184   
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
G2/mitotic-specific cyclin-B


(Asterina pectinifera)		BDBM50488796
PNG
(CHEMBL2295954)
Show SMILES CC(C)C[C@@H](O)Nc1nc(Nc2ccc(cc2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C23H28N8O/c1-14(2)9-19(32)28-23-29-21(20-22(30-23)31(13-26-20)15(3)4)27-18-7-5-16(6-8-18)17-10-24-12-25-11-17/h5-8,10-15,19,32H,9H2,1-4H3,(H2,27,28,29,30)/t19-/m1/s1
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TBA

Assay Description
Inhibition of Asteroidea (starfish) Cyclin-dependent kinase 1/cyclin B isolated from oocyte using histone H1 and [gamma33P]ATP as substrate after 30 ...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))		BDBM50488796
PNG
(CHEMBL2295954)
Show SMILES CC(C)C[C@@H](O)Nc1nc(Nc2ccc(cc2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C23H28N8O/c1-14(2)9-19(32)28-23-29-21(20-22(30-23)31(13-26-20)15(3)4)27-18-7-5-16(6-8-18)17-10-24-12-25-11-17/h5-8,10-15,19,32H,9H2,1-4H3,(H2,27,28,29,30)/t19-/m1/s1
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TBA

Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5


(Homo sapiens (Human))		BDBM50259155
PNG
((Z)-Hymenialdisine | Hymenialdisine)
Show SMILES NC1=NC(=O)\C(N1)=C1/CCNC(=O)c2[nH]c(Br)cc12 |t:1|
Show InChI InChI=1S/C11H10BrN5O2/c12-6-3-5-4(7-10(19)17-11(13)16-7)1-2-14-9(18)8(5)15-6/h3,15H,1-2H2,(H,14,18)(H3,13,16,17,19)/b7-4-
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TBA

Assay Description
Inhibition of CDK5 (unknown origin)

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))		BDBM50488796
PNG
(CHEMBL2295954)
Show SMILES CC(C)C[C@@H](O)Nc1nc(Nc2ccc(cc2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C23H28N8O/c1-14(2)9-19(32)28-23-29-21(20-22(30-23)31(13-26-20)15(3)4)27-18-7-5-16(6-8-18)17-10-24-12-25-11-17/h5-8,10-15,19,32H,9H2,1-4H3,(H2,27,28,29,30)/t19-/m1/s1
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TBA

Assay Description
Inhibition of human recombinant CDK2/cyclin A using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
G2/mitotic-specific cyclin-B


(Asterina pectinifera)		BDBM50488820
PNG
(CHEMBL2295952)
Show SMILES CCC[C@@H](O)Nc1nc(Nc2ccc(cc2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-5-18(31)27-22-28-20(19-21(29-22)30(13-25-19)14(2)3)26-17-8-6-15(7-9-17)16-10-23-12-24-11-16/h6-14,18,31H,4-5H2,1-3H3,(H2,26,27,28,29)/t18-/m1/s1
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TBA

Assay Description
Inhibition of Asteroidea (starfish) Cyclin-dependent kinase 1/cyclin B isolated from oocyte using histone H1 and [gamma33P]ATP as substrate after 30 ...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))		BDBM50488816
PNG
(CHEMBL2295937)
Show SMILES CC(C)C[C@@H](O)Nc1nc(Nc2cccc(c2)-c2ncccn2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C23H28N8O/c1-14(2)11-18(32)28-23-29-21(19-22(30-23)31(13-26-19)15(3)4)27-17-8-5-7-16(12-17)20-24-9-6-10-25-20/h5-10,12-15,18,32H,11H2,1-4H3,(H2,27,28,29,30)/t18-/m1/s1
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TBA

Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Casein kinase 1, delta tv1


(Sus scrofa)		BDBM50488801
PNG
(CHEMBL2295939)
Show SMILES CC(C)C(O)Nc1nc(Nc2cccc(c2)-c2ncccn2)c2ncn(C(C)C)c2n1
Show InChI InChI=1S/C22H26N8O/c1-13(2)21(31)29-22-27-19(17-20(28-22)30(12-25-17)14(3)4)26-16-8-5-7-15(11-16)18-23-9-6-10-24-18/h5-14,21,31H,1-4H3,(H2,26,27,28,29)
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TBA

Assay Description
Inhibition of Sus scrofa (pig) casein kinase 1delta/epsilon isolated from brain using RRKHAAIGpSAYSITA and [gamma33P]ATP as substrate after 30 min by...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))		BDBM50488817
PNG
(CHEMBL2295945)
Show SMILES CC(C)C[C@@H](O)Nc1nc(Nc2cccc(c2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C23H28N8O/c1-14(2)8-19(32)28-23-29-21(20-22(30-23)31(13-26-20)15(3)4)27-18-7-5-6-16(9-18)17-10-24-12-25-11-17/h5-7,9-15,19,32H,8H2,1-4H3,(H2,27,28,29,30)/t19-/m1/s1
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TBA

Assay Description
Inhibition of human recombinant CDK2/cyclin A using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))		BDBM50488817
PNG
(CHEMBL2295945)
Show SMILES CC(C)C[C@@H](O)Nc1nc(Nc2cccc(c2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C23H28N8O/c1-14(2)8-19(32)28-23-29-21(20-22(30-23)31(13-26-20)15(3)4)27-18-7-5-6-16(9-18)17-10-24-12-25-11-17/h5-7,9-15,19,32H,8H2,1-4H3,(H2,27,28,29,30)/t19-/m1/s1
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TBA

Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))		BDBM50488820
PNG
(CHEMBL2295952)
Show SMILES CCC[C@@H](O)Nc1nc(Nc2ccc(cc2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-5-18(31)27-22-28-20(19-21(29-22)30(13-25-19)14(2)3)26-17-8-6-15(7-9-17)16-10-23-12-24-11-16/h6-14,18,31H,4-5H2,1-3H3,(H2,26,27,28,29)/t18-/m1/s1
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TBA

Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Casein kinase 1, delta tv1


(Sus scrofa)		BDBM50488816
PNG
(CHEMBL2295937)
Show SMILES CC(C)C[C@@H](O)Nc1nc(Nc2cccc(c2)-c2ncccn2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C23H28N8O/c1-14(2)11-18(32)28-23-29-21(19-22(30-23)31(13-26-19)15(3)4)27-17-8-5-7-16(12-17)20-24-9-6-10-25-20/h5-10,12-15,18,32H,11H2,1-4H3,(H2,27,28,29,30)/t18-/m1/s1
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TBA

Assay Description
Inhibition of Sus scrofa (pig) casein kinase 1delta/epsilon isolated from brain using RRKHAAIGpSAYSITA and [gamma33P]ATP as substrate after 30 min by...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Casein kinase 1, delta tv1


(Sus scrofa)		BDBM50488812
PNG
(CHEMBL2295960)
Show SMILES CCC[C@@H](O)Nc1nc(Nc2cccc(c2)-c2ncccn2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-7-17(31)27-22-28-20(18-21(29-22)30(13-25-18)14(2)3)26-16-9-5-8-15(12-16)19-23-10-6-11-24-19/h5-6,8-14,17,31H,4,7H2,1-3H3,(H2,26,27,28,29)/t17-/m1/s1
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TBA

Assay Description
Inhibition of Sus scrofa (pig) casein kinase 1delta/epsilon isolated from brain using RRKHAAIGpSAYSITA and [gamma33P]ATP as substrate after 30 min by...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Casein kinase 1, delta tv1


(Sus scrofa)		BDBM50488799
PNG
(CHEMBL2295959)
Show SMILES CC(C)n1cnc2c(Nc3cccc(c3)-c3ncccn3)nc(Cl)nc12
Show InChI InChI=1S/C18H16ClN7/c1-11(2)26-10-22-14-16(24-18(19)25-17(14)26)23-13-6-3-5-12(9-13)15-20-7-4-8-21-15/h3-11H,1-2H3,(H,23,24,25)
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TBA

Assay Description
Inhibition of Sus scrofa (pig) casein kinase 1delta/epsilon isolated from brain using RRKHAAIGpSAYSITA and [gamma33P]ATP as substrate after 30 min by...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Casein kinase 1, delta tv1


(Sus scrofa)		BDBM50488815
PNG
(CHEMBL2295940)
Show SMILES CC(O)C(O)Nc1nc(Nc2cccc(c2)-c2ncccn2)c2ncn(C(C)C)c2n1
Show InChI InChI=1S/C21H24N8O2/c1-12(2)29-11-24-16-18(26-21(27-19(16)29)28-20(31)13(3)30)25-15-7-4-6-14(10-15)17-22-8-5-9-23-17/h4-13,20,30-31H,1-3H3,(H2,25,26,27,28)
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TBA

Assay Description
Inhibition of Sus scrofa (pig) casein kinase 1delta/epsilon isolated from brain using RRKHAAIGpSAYSITA and [gamma33P]ATP as substrate after 30 min by...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))		BDBM50488813
PNG
(CHEMBL2295943)
Show SMILES CCC[C@@H](O)Nc1nc(Nc2cccc(c2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-6-18(31)27-22-28-20(19-21(29-22)30(13-25-19)14(2)3)26-17-8-5-7-15(9-17)16-10-23-12-24-11-16/h5,7-14,18,31H,4,6H2,1-3H3,(H2,26,27,28,29)/t18-/m1/s1
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TBA

Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
G2/mitotic-specific cyclin-B


(Asterina pectinifera)		BDBM50488808
PNG
(CHEMBL2295953)
Show SMILES CCC[C@H](O)Nc1nc(Nc2ccc(cc2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-5-18(31)27-22-28-20(19-21(29-22)30(13-25-19)14(2)3)26-17-8-6-15(7-9-17)16-10-23-12-24-11-16/h6-14,18,31H,4-5H2,1-3H3,(H2,26,27,28,29)/t18-/m0/s1
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TBA

Assay Description
Inhibition of Asteroidea (starfish) Cyclin-dependent kinase 1/cyclin B isolated from oocyte using histone H1 and [gamma33P]ATP as substrate after 30 ...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))		BDBM50488816
PNG
(CHEMBL2295937)
Show SMILES CC(C)C[C@@H](O)Nc1nc(Nc2cccc(c2)-c2ncccn2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C23H28N8O/c1-14(2)11-18(32)28-23-29-21(19-22(30-23)31(13-26-19)15(3)4)27-17-8-5-7-16(12-17)20-24-9-6-10-25-20/h5-10,12-15,18,32H,11H2,1-4H3,(H2,27,28,29,30)/t18-/m1/s1
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TBA

Assay Description
Inhibition of human recombinant CDK2/cyclin A using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))		BDBM50488819
PNG
(CHEMBL2295949)
Show SMILES CC(C)C[C@@H](O)Nc1nc(Nc2ccc(cc2)-c2ncccn2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C23H28N8O/c1-14(2)12-18(32)28-23-29-21(19-22(30-23)31(13-26-19)15(3)4)27-17-8-6-16(7-9-17)20-24-10-5-11-25-20/h5-11,13-15,18,32H,12H2,1-4H3,(H2,27,28,29,30)/t18-/m1/s1
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TBA

Assay Description
Inhibition of human recombinant CDK2/cyclin A using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))		BDBM50488819
PNG
(CHEMBL2295949)
Show SMILES CC(C)C[C@@H](O)Nc1nc(Nc2ccc(cc2)-c2ncccn2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C23H28N8O/c1-14(2)12-18(32)28-23-29-21(19-22(30-23)31(13-26-19)15(3)4)27-17-8-6-16(7-9-17)20-24-10-5-11-25-20/h5-11,13-15,18,32H,12H2,1-4H3,(H2,27,28,29,30)/t18-/m1/s1
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TBA

Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Casein kinase 1, delta tv1


(Sus scrofa)		BDBM50488797
PNG
(CHEMBL2295936)
Show SMILES CCC[C@H](O)Nc1nc(Nc2cccc(c2)-c2ncccn2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-7-17(31)27-22-28-20(18-21(29-22)30(13-25-18)14(2)3)26-16-9-5-8-15(12-16)19-23-10-6-11-24-19/h5-6,8-14,17,31H,4,7H2,1-3H3,(H2,26,27,28,29)/t17-/m0/s1
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TBA

Assay Description
Inhibition of Sus scrofa (pig) casein kinase 1delta/epsilon isolated from brain using RRKHAAIGpSAYSITA and [gamma33P]ATP as substrate after 30 min by...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))		BDBM50488809
PNG
(CHEMBL2295947)
Show SMILES CCC[C@@H](O)Nc1nc(Nc2ccc(cc2)-c2ncccn2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-6-17(31)27-22-28-20(18-21(29-22)30(13-25-18)14(2)3)26-16-9-7-15(8-10-16)19-23-11-5-12-24-19/h5,7-14,17,31H,4,6H2,1-3H3,(H2,26,27,28,29)/t17-/m1/s1
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TBA

Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))		BDBM50488805
PNG
(CHEMBL2295946)
Show SMILES CC(C)C(O)Nc1nc(Nc2cccc(c2)-c2cncnc2)c2ncn(C(C)C)c2n1
Show InChI InChI=1S/C22H26N8O/c1-13(2)21(31)29-22-27-19(18-20(28-22)30(12-25-18)14(3)4)26-17-7-5-6-15(8-17)16-9-23-11-24-10-16/h5-14,21,31H,1-4H3,(H2,26,27,28,29)
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TBA

Assay Description
Inhibition of human recombinant CDK2/cyclin A using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))		BDBM50488805
PNG
(CHEMBL2295946)
Show SMILES CC(C)C(O)Nc1nc(Nc2cccc(c2)-c2cncnc2)c2ncn(C(C)C)c2n1
Show InChI InChI=1S/C22H26N8O/c1-13(2)21(31)29-22-27-19(18-20(28-22)30(12-25-18)14(3)4)26-17-7-5-6-15(8-17)16-9-23-11-24-10-16/h5-14,21,31H,1-4H3,(H2,26,27,28,29)
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TBA

Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))		BDBM50488818
PNG
(CHEMBL2295958)
Show SMILES CC(C)C(O)Nc1nc(Nc2ccc(cc2)-c2cncnc2)c2ncn(C(C)C)c2n1
Show InChI InChI=1S/C22H26N8O/c1-13(2)21(31)29-22-27-19(18-20(28-22)30(12-25-18)14(3)4)26-17-7-5-15(6-8-17)16-9-23-11-24-10-16/h5-14,21,31H,1-4H3,(H2,26,27,28,29)
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TBA

Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))		BDBM50488801
PNG
(CHEMBL2295939)
Show SMILES CC(C)C(O)Nc1nc(Nc2cccc(c2)-c2ncccn2)c2ncn(C(C)C)c2n1
Show InChI InChI=1S/C22H26N8O/c1-13(2)21(31)29-22-27-19(17-20(28-22)30(12-25-17)14(3)4)26-16-8-5-7-15(11-16)18-23-9-6-10-24-18/h5-14,21,31H,1-4H3,(H2,26,27,28,29)
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TBA

Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
G2/mitotic-specific cyclin-B


(Asterina pectinifera)		BDBM50488813
PNG
(CHEMBL2295943)
Show SMILES CCC[C@@H](O)Nc1nc(Nc2cccc(c2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-6-18(31)27-22-28-20(19-21(29-22)30(13-25-19)14(2)3)26-17-8-5-7-15(9-17)16-10-23-12-24-11-16/h5,7-14,18,31H,4,6H2,1-3H3,(H2,26,27,28,29)/t18-/m1/s1
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TBA

Assay Description
Inhibition of Asteroidea (starfish) Cyclin-dependent kinase 1/cyclin B isolated from oocyte using histone H1 and [gamma33P]ATP as substrate after 30 ...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))		BDBM50488806
PNG
(CHEMBL2295956)
Show SMILES CC(C)CC[C@H](O)Nc1nc(Nc2ccc(cc2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C24H30N8O/c1-15(2)5-10-20(33)29-24-30-22(21-23(31-24)32(14-27-21)16(3)4)28-19-8-6-17(7-9-19)18-11-25-13-26-12-18/h6-9,11-16,20,33H,5,10H2,1-4H3,(H2,28,29,30,31)/t20-/m0/s1
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TBA

Assay Description
Inhibition of human recombinant CDK2/cyclin A using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Casein kinase 1, delta tv1


(Sus scrofa)		BDBM50488810
PNG
(CHEMBL2295938)
Show SMILES CC(C)C[C@H](O)Nc1nc(Nc2cccc(c2)-c2ncccn2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C23H28N8O/c1-14(2)11-18(32)28-23-29-21(19-22(30-23)31(13-26-19)15(3)4)27-17-8-5-7-16(12-17)20-24-9-6-10-25-20/h5-10,12-15,18,32H,11H2,1-4H3,(H2,27,28,29,30)/t18-/m0/s1
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TBA

Assay Description
Inhibition of Sus scrofa (pig) casein kinase 1delta/epsilon isolated from brain using RRKHAAIGpSAYSITA and [gamma33P]ATP as substrate after 30 min by...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
G2/mitotic-specific cyclin-B


(Asterina pectinifera)		BDBM50488809
PNG
(CHEMBL2295947)
Show SMILES CCC[C@@H](O)Nc1nc(Nc2ccc(cc2)-c2ncccn2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-6-17(31)27-22-28-20(18-21(29-22)30(13-25-18)14(2)3)26-16-9-7-15(8-10-16)19-23-11-5-12-24-19/h5,7-14,17,31H,4,6H2,1-3H3,(H2,26,27,28,29)/t17-/m1/s1
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TBA

Assay Description
Inhibition of Asteroidea (starfish) Cyclin-dependent kinase 1/cyclin B isolated from oocyte using histone H1 and [gamma33P]ATP as substrate after 30 ...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))		BDBM50488811
PNG
(CHEMBL2295957)
Show SMILES CC(C)n1cnc2c(Nc3ccc(cc3)-c3cncnc3)nc(NC(O)CCO)nc12
Show InChI InChI=1S/C21H24N8O2/c1-13(2)29-12-24-18-19(27-21(28-20(18)29)26-17(31)7-8-30)25-16-5-3-14(4-6-16)15-9-22-11-23-10-15/h3-6,9-13,17,30-31H,7-8H2,1-2H3,(H2,25,26,27,28)
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TBA

Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Casein kinase 1, delta tv1


(Sus scrofa)		BDBM50488798
PNG
(CHEMBL2295944)
Show SMILES CCC[C@H](O)Nc1nc(Nc2cccc(c2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-6-18(31)27-22-28-20(19-21(29-22)30(13-25-19)14(2)3)26-17-8-5-7-15(9-17)16-10-23-12-24-11-16/h5,7-14,18,31H,4,6H2,1-3H3,(H2,26,27,28,29)/t18-/m0/s1
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TBA

Assay Description
Inhibition of Sus scrofa (pig) casein kinase 1delta/epsilon isolated from brain using RRKHAAIGpSAYSITA and [gamma33P]ATP as substrate after 30 min by...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))		BDBM50488818
PNG
(CHEMBL2295958)
Show SMILES CC(C)C(O)Nc1nc(Nc2ccc(cc2)-c2cncnc2)c2ncn(C(C)C)c2n1
Show InChI InChI=1S/C22H26N8O/c1-13(2)21(31)29-22-27-19(18-20(28-22)30(12-25-18)14(3)4)26-17-7-5-15(6-8-17)16-9-23-11-24-10-16/h5-14,21,31H,1-4H3,(H2,26,27,28,29)
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TBA

Assay Description
Inhibition of human recombinant CDK2/cyclin A using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))		BDBM50488808
PNG
(CHEMBL2295953)
Show SMILES CCC[C@H](O)Nc1nc(Nc2ccc(cc2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-5-18(31)27-22-28-20(19-21(29-22)30(13-25-19)14(2)3)26-17-8-6-15(7-9-17)16-10-23-12-24-11-16/h6-14,18,31H,4-5H2,1-3H3,(H2,26,27,28,29)/t18-/m0/s1
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TBA

Assay Description
Inhibition of human recombinant CDK2/cyclin A using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))		BDBM50488808
PNG
(CHEMBL2295953)
Show SMILES CCC[C@H](O)Nc1nc(Nc2ccc(cc2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-5-18(31)27-22-28-20(19-21(29-22)30(13-25-19)14(2)3)26-17-8-6-15(7-9-17)16-10-23-12-24-11-16/h6-14,18,31H,4-5H2,1-3H3,(H2,26,27,28,29)/t18-/m0/s1
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TBA

Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))		BDBM50488812
PNG
(CHEMBL2295960)
Show SMILES CCC[C@@H](O)Nc1nc(Nc2cccc(c2)-c2ncccn2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-7-17(31)27-22-28-20(18-21(29-22)30(13-25-18)14(2)3)26-16-9-5-8-15(12-16)19-23-10-6-11-24-19/h5-6,8-14,17,31H,4,7H2,1-3H3,(H2,26,27,28,29)/t17-/m1/s1
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TBA

Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
G2/mitotic-specific cyclin-B


(Asterina pectinifera)		BDBM50488800
PNG
(CHEMBL2295955)
Show SMILES CC(C)C[C@H](O)Nc1nc(Nc2ccc(cc2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C23H28N8O/c1-14(2)9-19(32)28-23-29-21(20-22(30-23)31(13-26-20)15(3)4)27-18-7-5-16(6-8-18)17-10-24-12-25-11-17/h5-8,10-15,19,32H,9H2,1-4H3,(H2,27,28,29,30)/t19-/m0/s1
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TBA

Assay Description
Inhibition of Asteroidea (starfish) Cyclin-dependent kinase 1/cyclin B isolated from oocyte using histone H1 and [gamma33P]ATP as substrate after 30 ...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))		BDBM50488803
PNG
(CHEMBL2295948)
Show SMILES CCC[C@H](O)Nc1nc(Nc2ccc(cc2)-c2ncccn2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-6-17(31)27-22-28-20(18-21(29-22)30(13-25-18)14(2)3)26-16-9-7-15(8-10-16)19-23-11-5-12-24-19/h5,7-14,17,31H,4,6H2,1-3H3,(H2,26,27,28,29)/t17-/m0/s1
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TBA

Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))		BDBM50488798
PNG
(CHEMBL2295944)
Show SMILES CCC[C@H](O)Nc1nc(Nc2cccc(c2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-6-18(31)27-22-28-20(19-21(29-22)30(13-25-19)14(2)3)26-17-8-5-7-15(9-17)16-10-23-12-24-11-16/h5,7-14,18,31H,4,6H2,1-3H3,(H2,26,27,28,29)/t18-/m0/s1
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TBA

Assay Description
Inhibition of human recombinant CDK5/p25 using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
G2/mitotic-specific cyclin-B


(Asterina pectinifera)		BDBM50488812
PNG
(CHEMBL2295960)
Show SMILES CCC[C@@H](O)Nc1nc(Nc2cccc(c2)-c2ncccn2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-7-17(31)27-22-28-20(18-21(29-22)30(13-25-18)14(2)3)26-16-9-5-8-15(12-16)19-23-10-6-11-24-19/h5-6,8-14,17,31H,4,7H2,1-3H3,(H2,26,27,28,29)/t17-/m1/s1
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TBA

Assay Description
Inhibition of Asteroidea (starfish) Cyclin-dependent kinase 1/cyclin B isolated from oocyte using histone H1 and [gamma33P]ATP as substrate after 30 ...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
G2/mitotic-specific cyclin-B


(Asterina pectinifera)		BDBM50488798
PNG
(CHEMBL2295944)
Show SMILES CCC[C@H](O)Nc1nc(Nc2cccc(c2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-6-18(31)27-22-28-20(19-21(29-22)30(13-25-19)14(2)3)26-17-8-5-7-15(9-17)16-10-23-12-24-11-16/h5,7-14,18,31H,4,6H2,1-3H3,(H2,26,27,28,29)/t18-/m0/s1
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Assay Description
Inhibition of Asteroidea (starfish) Cyclin-dependent kinase 1/cyclin B isolated from oocyte using histone H1 and [gamma33P]ATP as substrate after 30 ...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Casein kinase 1, delta tv1


(Sus scrofa)		BDBM50488813
PNG
(CHEMBL2295943)
Show SMILES CCC[C@@H](O)Nc1nc(Nc2cccc(c2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-6-18(31)27-22-28-20(19-21(29-22)30(13-25-19)14(2)3)26-17-8-5-7-15(9-17)16-10-23-12-24-11-16/h5,7-14,18,31H,4,6H2,1-3H3,(H2,26,27,28,29)/t18-/m1/s1
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TBA

Assay Description
Inhibition of Sus scrofa (pig) casein kinase 1delta/epsilon isolated from brain using RRKHAAIGpSAYSITA and [gamma33P]ATP as substrate after 30 min by...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Casein kinase 1, delta tv1


(Sus scrofa)		BDBM50488807
PNG
(CHEMBL2295941)
Show SMILES CC(C)CC[C@H](O)Nc1nc(Nc2cccc(c2)-c2ncccn2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C24H30N8O/c1-15(2)9-10-19(33)29-24-30-22(20-23(31-24)32(14-27-20)16(3)4)28-18-8-5-7-17(13-18)21-25-11-6-12-26-21/h5-8,11-16,19,33H,9-10H2,1-4H3,(H2,28,29,30,31)/t19-/m0/s1
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Inhibition of Sus scrofa (pig) casein kinase 1delta/epsilon isolated from brain using RRKHAAIGpSAYSITA and [gamma33P]ATP as substrate after 30 min by...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))		BDBM50488797
PNG
(CHEMBL2295936)
Show SMILES CCC[C@H](O)Nc1nc(Nc2cccc(c2)-c2ncccn2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-7-17(31)27-22-28-20(18-21(29-22)30(13-25-18)14(2)3)26-16-9-5-8-15(12-16)19-23-10-6-11-24-19/h5-6,8-14,17,31H,4,7H2,1-3H3,(H2,26,27,28,29)/t17-/m0/s1
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TBA

Assay Description
Inhibition of human recombinant CDK2/cyclin A using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Casein kinase 1, delta tv1


(Sus scrofa)		BDBM50488805
PNG
(CHEMBL2295946)
Show SMILES CC(C)C(O)Nc1nc(Nc2cccc(c2)-c2cncnc2)c2ncn(C(C)C)c2n1
Show InChI InChI=1S/C22H26N8O/c1-13(2)21(31)29-22-27-19(18-20(28-22)30(12-25-18)14(3)4)26-17-7-5-6-15(8-17)16-9-23-11-24-10-16/h5-14,21,31H,1-4H3,(H2,26,27,28,29)
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Assay Description
Inhibition of Sus scrofa (pig) casein kinase 1delta/epsilon isolated from brain using RRKHAAIGpSAYSITA and [gamma33P]ATP as substrate after 30 min by...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))		BDBM50488811
PNG
(CHEMBL2295957)
Show SMILES CC(C)n1cnc2c(Nc3ccc(cc3)-c3cncnc3)nc(NC(O)CCO)nc12
Show InChI InChI=1S/C21H24N8O2/c1-13(2)29-12-24-18-19(27-21(28-20(18)29)26-17(31)7-8-30)25-16-5-3-14(4-6-16)15-9-22-11-23-10-15/h3-6,9-13,17,30-31H,7-8H2,1-2H3,(H2,25,26,27,28)
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Inhibition of human recombinant CDK2/cyclin A using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Casein kinase 1, delta tv1


(Sus scrofa)		BDBM50488796
PNG
(CHEMBL2295954)
Show SMILES CC(C)C[C@@H](O)Nc1nc(Nc2ccc(cc2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C23H28N8O/c1-14(2)9-19(32)28-23-29-21(20-22(30-23)31(13-26-20)15(3)4)27-18-7-5-16(6-8-18)17-10-24-12-25-11-17/h5-8,10-15,19,32H,9H2,1-4H3,(H2,27,28,29,30)/t19-/m1/s1
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Inhibition of Sus scrofa (pig) casein kinase 1delta/epsilon isolated from brain using RRKHAAIGpSAYSITA and [gamma33P]ATP as substrate after 30 min by...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))		BDBM50488803
PNG
(CHEMBL2295948)
Show SMILES CCC[C@H](O)Nc1nc(Nc2ccc(cc2)-c2ncccn2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C22H26N8O/c1-4-6-17(31)27-22-28-20(18-21(29-22)30(13-25-18)14(2)3)26-16-9-7-15(8-10-16)19-23-11-5-12-24-19/h5,7-14,17,31H,4,6H2,1-3H3,(H2,26,27,28,29)/t17-/m0/s1
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Inhibition of human recombinant CDK2/cyclin A using histone H1 and [gamma33P]ATP as substrate after 30 min by scintillation counting

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Casein kinase 1, delta tv1


(Sus scrofa)		BDBM50488814
PNG
(CHEMBL2295942)
Show SMILES CC(C)n1cnc2c(Nc3cccc(c3)-c3cncnc3)nc(Cl)nc12
Show InChI InChI=1S/C18H16ClN7/c1-11(2)26-10-22-15-16(24-18(19)25-17(15)26)23-14-5-3-4-12(6-14)13-7-20-9-21-8-13/h3-11H,1-2H3,(H,23,24,25)
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Inhibition of Sus scrofa (pig) casein kinase 1delta/epsilon isolated from brain using RRKHAAIGpSAYSITA and [gamma33P]ATP as substrate after 30 min by...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Casein kinase 1, delta tv1


(Sus scrofa)		BDBM50488817
PNG
(CHEMBL2295945)
Show SMILES CC(C)C[C@@H](O)Nc1nc(Nc2cccc(c2)-c2cncnc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C23H28N8O/c1-14(2)8-19(32)28-23-29-21(20-22(30-23)31(13-26-20)15(3)4)27-18-7-5-6-16(9-18)17-10-24-12-25-11-17/h5-7,9-15,19,32H,8H2,1-4H3,(H2,27,28,29,30)/t19-/m1/s1
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Inhibition of Sus scrofa (pig) casein kinase 1delta/epsilon isolated from brain using RRKHAAIGpSAYSITA and [gamma33P]ATP as substrate after 30 min by...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
Casein kinase 1, delta tv1


(Sus scrofa)		BDBM50488802
PNG
(CHEMBL2295951)
Show SMILES CC(C)n1cnc2c(Nc3ccc(cc3)-c3cncnc3)nc(Cl)nc12
Show InChI InChI=1S/C18H16ClN7/c1-11(2)26-10-22-15-16(24-18(19)25-17(15)26)23-14-5-3-12(4-6-14)13-7-20-9-21-8-13/h3-11H,1-2H3,(H,23,24,25)
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Assay Description
Inhibition of Sus scrofa (pig) casein kinase 1delta/epsilon isolated from brain using RRKHAAIGpSAYSITA and [gamma33P]ATP as substrate after 30 min by...

Citation and Details

Article DOI: 10.1007/s00044-012-0334-1
BindingDB Entry DOI: 10.7270/Q2ZP490F
More data for this
Ligand-Target Pair
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