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PubMed code 25191940

Compile data set for download or QSAR
Found 48 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
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025019
PNG
(CHEMBL3337845)
Show SMILES FC(F)(F)Oc1ccccc1C(=O)Nc1nc(cs1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C20H10F5N5O5S/c21-19(22,23)33-12-4-2-1-3-8(12)15(31)30-18-28-11(7-36-18)16(32)29-17-26-9-5-13-14(6-10(9)27-17)35-20(24,25)34-13/h1-7H,(H,28,30,31)(H2,26,27,29,32)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of rat CK1delta kinetic domain expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025016
PNG
(CHEMBL3337849)
Show SMILES CN(C)c1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C17H14F2N4O3/c1-23(2)10-5-3-4-9(6-10)15(24)22-16-20-11-7-13-14(8-12(11)21-16)26-17(18,19)25-13/h3-8H,1-2H3,(H2,20,21,22,24)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of rat CK1delta by radiometric protein kinase filter binding assay


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025019
PNG
(CHEMBL3337845)
Show SMILES FC(F)(F)Oc1ccccc1C(=O)Nc1nc(cs1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C20H10F5N5O5S/c21-19(22,23)33-12-4-2-1-3-8(12)15(31)30-18-28-11(7-36-18)16(32)29-17-26-9-5-13-14(6-10(9)27-17)35-20(24,25)34-13/h1-7H,(H,28,30,31)(H2,26,27,29,32)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged rat CK1delta expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025019
PNG
(CHEMBL3337845)
Show SMILES FC(F)(F)Oc1ccccc1C(=O)Nc1nc(cs1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C20H10F5N5O5S/c21-19(22,23)33-12-4-2-1-3-8(12)15(31)30-18-28-11(7-36-18)16(32)29-17-26-9-5-13-14(6-10(9)27-17)35-20(24,25)34-13/h1-7H,(H,28,30,31)(H2,26,27,29,32)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of rat CK1delta kinetic domain expressed in Escherichia coli using alpha casein substrate by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025020
PNG
(CHEMBL3337854)
Show SMILES FC(F)(F)Oc1ccccc1C(=O)Nc1nc(cs1)C(=O)Nc1nc2ccc(cc2[nH]1)C(F)(F)F
Show InChI InChI=1S/C20H11F6N5O3S/c21-19(22,23)9-5-6-11-12(7-9)28-17(27-11)30-16(33)13-8-35-18(29-13)31-15(32)10-3-1-2-4-14(10)34-20(24,25)26/h1-8H,(H,29,31,32)(H2,27,28,30,33)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of rat CK1delta kinetic domain expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025015
PNG
(CHEMBL3337846)
Show SMILES COc1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C16H11F2N3O4/c1-23-9-4-2-3-8(5-9)14(22)21-15-19-10-6-12-13(7-11(10)20-15)25-16(17,18)24-12/h2-7H,1H3,(H2,19,20,21,22)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of rat CK1delta by radiometric protein kinase filter binding assay


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025020
PNG
(CHEMBL3337854)
Show SMILES FC(F)(F)Oc1ccccc1C(=O)Nc1nc(cs1)C(=O)Nc1nc2ccc(cc2[nH]1)C(F)(F)F
Show InChI InChI=1S/C20H11F6N5O3S/c21-19(22,23)9-5-6-11-12(7-9)28-17(27-11)30-16(33)13-8-35-18(29-13)31-15(32)10-3-1-2-4-14(10)34-20(24,25)26/h1-8H,(H,29,31,32)(H2,27,28,30,33)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged rat CK1delta expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025019
PNG
(CHEMBL3337845)
Show SMILES FC(F)(F)Oc1ccccc1C(=O)Nc1nc(cs1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C20H10F5N5O5S/c21-19(22,23)33-12-4-2-1-3-8(12)15(31)30-18-28-11(7-36-18)16(32)29-17-26-9-5-13-14(6-10(9)27-17)35-20(24,25)34-13/h1-7H,(H,28,30,31)(H2,26,27,29,32)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged rat CK1delta expressed in Escherichia coli using alpha casein substrate by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025015
PNG
(CHEMBL3337846)
Show SMILES COc1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C16H11F2N3O4/c1-23-9-4-2-3-8(5-9)14(22)21-15-19-10-6-12-13(7-11(10)20-15)25-16(17,18)24-12/h2-7H,1H3,(H2,19,20,21,22)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of rat CK1delta kinetic domain expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025017
PNG
(CHEMBL3337855)
Show SMILES COc1ccc(cc1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C16H11F2N3O4/c1-23-9-4-2-8(3-5-9)14(22)21-15-19-10-6-12-13(7-11(10)20-15)25-16(17,18)24-12/h2-7H,1H3,(H2,19,20,21,22)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of rat CK1delta by radiometric protein kinase filter binding assay


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025015
PNG
(CHEMBL3337846)
Show SMILES COc1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C16H11F2N3O4/c1-23-9-4-2-3-8(5-9)14(22)21-15-19-10-6-12-13(7-11(10)20-15)25-16(17,18)24-12/h2-7H,1H3,(H2,19,20,21,22)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged rat CK1delta expressed in Escherichia coli using alpha casein substrate by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025024
PNG
(CHEMBL3337850)
Show SMILES CN(C)c1cc(ccn1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C16H13F2N5O3/c1-23(2)13-5-8(3-4-19-13)14(24)22-15-20-9-6-11-12(7-10(9)21-15)26-16(17,18)25-11/h3-7H,1-2H3,(H2,20,21,22,24)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged rat CK1delta expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025015
PNG
(CHEMBL3337846)
Show SMILES COc1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C16H11F2N3O4/c1-23-9-4-2-3-8(5-9)14(22)21-15-19-10-6-12-13(7-11(10)20-15)25-16(17,18)24-12/h2-7H,1H3,(H2,19,20,21,22)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged rat CK1delta expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta/epsilon


(Homo sapiens (Human))
BDBM50025015
PNG
(CHEMBL3337846)
Show SMILES COc1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C16H11F2N3O4/c1-23-9-4-2-3-8(5-9)14(22)21-15-19-10-6-12-13(7-11(10)20-15)25-16(17,18)24-12/h2-7H,1H3,(H2,19,20,21,22)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CK1epsilon expressed in Escherichia coli using alpha casein substrate by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I isoform alpha


(Bos taurus)
BDBM50025019
PNG
(CHEMBL3337845)
Show SMILES FC(F)(F)Oc1ccccc1C(=O)Nc1nc(cs1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C20H10F5N5O5S/c21-19(22,23)33-12-4-2-1-3-8(12)15(31)30-18-28-11(7-36-18)16(32)29-17-26-9-5-13-14(6-10(9)27-17)35-20(24,25)34-13/h1-7H,(H,28,30,31)(H2,26,27,29,32)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged bovine CK1alpha expressed in Escherichia coli using alpha casein substrate by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025015
PNG
(CHEMBL3337846)
Show SMILES COc1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C16H11F2N3O4/c1-23-9-4-2-3-8(5-9)14(22)21-15-19-10-6-12-13(7-11(10)20-15)25-16(17,18)24-12/h2-7H,1H3,(H2,19,20,21,22)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of rat CK1delta kinetic domain expressed in Escherichia coli using alpha casein substrate by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025023
PNG
(CHEMBL3337851)
Show SMILES FC(F)Oc1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C16H9F4N3O4/c17-14(18)25-8-3-1-2-7(4-8)13(24)23-15-21-9-5-11-12(6-10(9)22-15)27-16(19,20)26-11/h1-6,14H,(H2,21,22,23,24)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of rat CK1delta kinetic domain expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025016
PNG
(CHEMBL3337849)
Show SMILES CN(C)c1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C17H14F2N4O3/c1-23(2)10-5-3-4-9(6-10)15(24)22-16-20-11-7-13-14(8-12(11)21-16)26-17(18,19)25-13/h3-8H,1-2H3,(H2,20,21,22,24)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of rat CK1delta kinetic domain expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta/epsilon


(Homo sapiens (Human))
BDBM50025019
PNG
(CHEMBL3337845)
Show SMILES FC(F)(F)Oc1ccccc1C(=O)Nc1nc(cs1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C20H10F5N5O5S/c21-19(22,23)33-12-4-2-1-3-8(12)15(31)30-18-28-11(7-36-18)16(32)29-17-26-9-5-13-14(6-10(9)27-17)35-20(24,25)34-13/h1-7H,(H,28,30,31)(H2,26,27,29,32)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CK1epsilon expressed in Escherichia coli using alpha casein substrate by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein kinase I delta/epsilon


(Homo sapiens (Human))
BDBM50025020
PNG
(CHEMBL3337854)
Show SMILES FC(F)(F)Oc1ccccc1C(=O)Nc1nc(cs1)C(=O)Nc1nc2ccc(cc2[nH]1)C(F)(F)F
Show InChI InChI=1S/C20H11F6N5O3S/c21-19(22,23)9-5-6-11-12(7-9)28-17(27-11)30-16(33)13-8-35-18(29-13)31-15(32)10-3-1-2-4-14(10)34-20(24,25)26/h1-8H,(H,29,31,32)(H2,27,28,30,33)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CK1epsilon expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025018
PNG
(CHEMBL3337856)
Show SMILES CN(C)c1ccc(cc1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C17H14F2N4O3/c1-23(2)10-5-3-9(4-6-10)15(24)22-16-20-11-7-13-14(8-12(11)21-16)26-17(18,19)25-13/h3-8H,1-2H3,(H2,20,21,22,24)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of rat CK1delta by radiometric protein kinase filter binding assay


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta/epsilon


(Homo sapiens (Human))
BDBM50025019
PNG
(CHEMBL3337845)
Show SMILES FC(F)(F)Oc1ccccc1C(=O)Nc1nc(cs1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C20H10F5N5O5S/c21-19(22,23)33-12-4-2-1-3-8(12)15(31)30-18-28-11(7-36-18)16(32)29-17-26-9-5-13-14(6-10(9)27-17)35-20(24,25)34-13/h1-7H,(H,28,30,31)(H2,26,27,29,32)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CK1epsilon expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025016
PNG
(CHEMBL3337849)
Show SMILES CN(C)c1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C17H14F2N4O3/c1-23(2)10-5-3-4-9(6-10)15(24)22-16-20-11-7-13-14(8-12(11)21-16)26-17(18,19)25-13/h3-8H,1-2H3,(H2,20,21,22,24)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged rat CK1delta expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025023
PNG
(CHEMBL3337851)
Show SMILES FC(F)Oc1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C16H9F4N3O4/c17-14(18)25-8-3-1-2-7(4-8)13(24)23-15-21-9-5-11-12(6-10(9)22-15)27-16(19,20)26-11/h1-6,14H,(H2,21,22,23,24)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged rat CK1delta expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025026
PNG
(CHEMBL3337847)
Show SMILES COc1cncc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C15H10F2N4O4/c1-23-8-2-7(5-18-6-8)13(22)21-14-19-9-3-11-12(4-10(9)20-14)25-15(16,17)24-11/h2-6H,1H3,(H2,19,20,21,22)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of rat CK1delta kinetic domain expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025024
PNG
(CHEMBL3337850)
Show SMILES CN(C)c1cc(ccn1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C16H13F2N5O3/c1-23(2)13-5-8(3-4-19-13)14(24)22-15-20-9-6-11-12(7-10(9)21-15)26-16(17,18)25-11/h3-7H,1-2H3,(H2,20,21,22,24)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of rat CK1delta kinetic domain expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025022
PNG
(CHEMBL3337852)
Show SMILES COC(=O)c1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C17H11F2N3O5/c1-25-15(24)9-4-2-3-8(5-9)14(23)22-16-20-10-6-12-13(7-11(10)21-16)27-17(18,19)26-12/h2-7H,1H3,(H2,20,21,22,23)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged rat CK1delta expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta/epsilon


(Homo sapiens (Human))
BDBM50025023
PNG
(CHEMBL3337851)
Show SMILES FC(F)Oc1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C16H9F4N3O4/c17-14(18)25-8-3-1-2-7(4-8)13(24)23-15-21-9-5-11-12(6-10(9)22-15)27-16(19,20)26-11/h1-6,14H,(H2,21,22,23,24)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CK1epsilon expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025022
PNG
(CHEMBL3337852)
Show SMILES COC(=O)c1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C17H11F2N3O5/c1-25-15(24)9-4-2-3-8(5-9)14(23)22-16-20-10-6-12-13(7-11(10)21-16)27-17(18,19)26-12/h2-7H,1H3,(H2,20,21,22,23)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of rat CK1delta kinetic domain expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta/epsilon


(Homo sapiens (Human))
BDBM50025024
PNG
(CHEMBL3337850)
Show SMILES CN(C)c1cc(ccn1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C16H13F2N5O3/c1-23(2)13-5-8(3-4-19-13)14(24)22-15-20-9-6-11-12(7-10(9)21-15)26-16(17,18)25-11/h3-7H,1-2H3,(H2,20,21,22,24)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CK1epsilon expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta/epsilon


(Homo sapiens (Human))
BDBM50025016
PNG
(CHEMBL3337849)
Show SMILES CN(C)c1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C17H14F2N4O3/c1-23(2)10-5-3-4-9(6-10)15(24)22-16-20-11-7-13-14(8-12(11)21-16)26-17(18,19)25-13/h3-8H,1-2H3,(H2,20,21,22,24)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CK1epsilon expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta/epsilon


(Homo sapiens (Human))
BDBM50025015
PNG
(CHEMBL3337846)
Show SMILES COc1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C16H11F2N3O4/c1-23-9-4-2-3-8(5-9)14(22)21-15-19-10-6-12-13(7-11(10)20-15)25-16(17,18)24-12/h2-7H,1H3,(H2,19,20,21,22)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CK1epsilon expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025021
PNG
(CHEMBL3337853)
Show SMILES FC1(F)Oc2cc3nc(NC(=O)c4cccc(c4)-c4nnn[nH]4)[nH]c3cc2O1
Show InChI InChI=1S/C16H9F2N7O3/c17-16(18)27-11-5-9-10(6-12(11)28-16)20-15(19-9)21-14(26)8-3-1-2-7(4-8)13-22-24-25-23-13/h1-6H,(H2,19,20,21,26)(H,22,23,24,25)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of rat CK1delta kinetic domain expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025021
PNG
(CHEMBL3337853)
Show SMILES FC1(F)Oc2cc3nc(NC(=O)c4cccc(c4)-c4nnn[nH]4)[nH]c3cc2O1
Show InChI InChI=1S/C16H9F2N7O3/c17-16(18)27-11-5-9-10(6-12(11)28-16)20-15(19-9)21-14(26)8-3-1-2-7(4-8)13-22-24-25-23-13/h1-6H,(H2,19,20,21,26)(H,22,23,24,25)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged rat CK1delta expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025026
PNG
(CHEMBL3337847)
Show SMILES COc1cncc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C15H10F2N4O4/c1-23-8-2-7(5-18-6-8)13(22)21-14-19-9-3-11-12(4-10(9)20-14)25-15(16,17)24-11/h2-6H,1H3,(H2,19,20,21,22)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged rat CK1delta expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025025
PNG
(CHEMBL3337848)
Show SMILES COc1cc(ccn1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C15H10F2N4O4/c1-23-12-4-7(2-3-18-12)13(22)21-14-19-8-5-10-11(6-9(8)20-14)25-15(16,17)24-10/h2-6H,1H3,(H2,19,20,21,22)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged rat CK1delta expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta/epsilon


(Homo sapiens (Human))
BDBM50025022
PNG
(CHEMBL3337852)
Show SMILES COC(=O)c1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C17H11F2N3O5/c1-25-15(24)9-4-2-3-8(5-9)14(23)22-16-20-10-6-12-13(7-11(10)21-16)27-17(18,19)26-12/h2-7H,1H3,(H2,20,21,22,23)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CK1epsilon expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta/epsilon


(Homo sapiens (Human))
BDBM50025021
PNG
(CHEMBL3337853)
Show SMILES FC1(F)Oc2cc3nc(NC(=O)c4cccc(c4)-c4nnn[nH]4)[nH]c3cc2O1
Show InChI InChI=1S/C16H9F2N7O3/c17-16(18)27-11-5-9-10(6-12(11)28-16)20-15(19-9)21-14(26)8-3-1-2-7(4-8)13-22-24-25-23-13/h1-6H,(H2,19,20,21,26)(H,22,23,24,25)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CK1epsilon expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025025
PNG
(CHEMBL3337848)
Show SMILES COc1cc(ccn1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C15H10F2N4O4/c1-23-12-4-7(2-3-18-12)13(22)21-14-19-8-5-10-11(6-9(8)20-14)25-15(16,17)24-10/h2-6H,1H3,(H2,19,20,21,22)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of rat CK1delta kinetic domain expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I isoform gamma-3


(Homo sapiens (Human))
BDBM50025015
PNG
(CHEMBL3337846)
Show SMILES COc1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C16H11F2N3O4/c1-23-9-4-2-3-8(5-9)14(22)21-15-19-10-6-12-13(7-11(10)20-15)25-16(17,18)24-12/h2-7H,1H3,(H2,19,20,21,22)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged human CK1gamma3 expressed in Escherichia coli using using alpha casein substrate by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I isoform gamma-3


(Homo sapiens (Human))
BDBM50025019
PNG
(CHEMBL3337845)
Show SMILES FC(F)(F)Oc1ccccc1C(=O)Nc1nc(cs1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C20H10F5N5O5S/c21-19(22,23)33-12-4-2-1-3-8(12)15(31)30-18-28-11(7-36-18)16(32)29-17-26-9-5-13-14(6-10(9)27-17)35-20(24,25)34-13/h1-7H,(H,28,30,31)(H2,26,27,29,32)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged human CK1gamma3 expressed in Escherichia coli using using alpha casein substrate by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta/epsilon


(Homo sapiens (Human))
BDBM50025026
PNG
(CHEMBL3337847)
Show SMILES COc1cncc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C15H10F2N4O4/c1-23-8-2-7(5-18-6-8)13(22)21-14-19-9-3-11-12(4-10(9)20-14)25-15(16,17)24-11/h2-6H,1H3,(H2,19,20,21,22)
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n/an/a 990n/an/an/an/an/an/a



Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CK1epsilon expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I isoform alpha


(Bos taurus)
BDBM50025015
PNG
(CHEMBL3337846)
Show SMILES COc1cccc(c1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C16H11F2N3O4/c1-23-9-4-2-3-8(5-9)14(22)21-15-19-10-6-12-13(7-11(10)20-15)25-16(17,18)24-12/h2-7H,1H3,(H2,19,20,21,22)
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n/an/a 1.36E+3n/an/an/an/an/an/a



Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged bovine CK1alpha expressed in Escherichia coli using alpha casein substrate by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta/epsilon


(Homo sapiens (Human))
BDBM50025025
PNG
(CHEMBL3337848)
Show SMILES COc1cc(ccn1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C15H10F2N4O4/c1-23-12-4-7(2-3-18-12)13(22)21-14-19-8-5-10-11(6-9(8)20-14)25-15(16,17)24-10/h2-6H,1H3,(H2,19,20,21,22)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CK1epsilon expressed in Escherichia coli using GST-p53 (1 to 64 residues) by SDS-PAGE based autoradiography


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025019
PNG
(CHEMBL3337845)
Show SMILES FC(F)(F)Oc1ccccc1C(=O)Nc1nc(cs1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C20H10F5N5O5S/c21-19(22,23)33-12-4-2-1-3-8(12)15(31)30-18-28-11(7-36-18)16(32)29-17-26-9-5-13-14(6-10(9)27-17)35-20(24,25)34-13/h1-7H,(H,28,30,31)(H2,26,27,29,32)
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n/an/a 2.01E+4n/an/an/an/an/an/a



Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged mouse CK1delta transcription variant 1 mutant expressed in Escherichia coli at 15 degC for 14 hrs using GST-p53 (1 to 64 res...


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025019
PNG
(CHEMBL3337845)
Show SMILES FC(F)(F)Oc1ccccc1C(=O)Nc1nc(cs1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C20H10F5N5O5S/c21-19(22,23)33-12-4-2-1-3-8(12)15(31)30-18-28-11(7-36-18)16(32)29-17-26-9-5-13-14(6-10(9)27-17)35-20(24,25)34-13/h1-7H,(H,28,30,31)(H2,26,27,29,32)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged mouse CK1delta transcription variant 2 mutant expressed in Escherichia coli at 15 degC for 14 hrs using GST-p53 (1 to 64 res...


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025019
PNG
(CHEMBL3337845)
Show SMILES FC(F)(F)Oc1ccccc1C(=O)Nc1nc(cs1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C20H10F5N5O5S/c21-19(22,23)33-12-4-2-1-3-8(12)15(31)30-18-28-11(7-36-18)16(32)29-17-26-9-5-13-14(6-10(9)27-17)35-20(24,25)34-13/h1-7H,(H,28,30,31)(H2,26,27,29,32)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged mouse CK1delta transcription variant 2 mutant expressed in Escherichia coli at 37 degC for 2 hrs using GST-p53 (1 to 64 resi...


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein kinase I delta


(Rattus norvegicus (rat))
BDBM50025019
PNG
(CHEMBL3337845)
Show SMILES FC(F)(F)Oc1ccccc1C(=O)Nc1nc(cs1)C(=O)Nc1nc2cc3OC(F)(F)Oc3cc2[nH]1
Show InChI InChI=1S/C20H10F5N5O5S/c21-19(22,23)33-12-4-2-1-3-8(12)15(31)30-18-28-11(7-36-18)16(32)29-17-26-9-5-13-14(6-10(9)27-17)35-20(24,25)34-13/h1-7H,(H,28,30,31)(H2,26,27,29,32)
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Ulm University Hospital

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged mouse CK1delta transcription variant 1 mutant expressed in Escherichia coli at 37 degC for 2 hrs using GST-p53 (1 to 64 resi...


J Med Chem 57: 7933-46 (2014)


Article DOI: 10.1021/jm500600b
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
* indicates data uncertainty>20%