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Compile Data Set for Download or QSAR

Found 40 hits Enz. Inhib. hit(s) with all data for entry = 50028657   
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
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50249959
PNG
(CHEMBL522428 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C25H24O5/c1-17(2)22-14-25(15-26,30-24(22)28)16-29-23(27)21-12-10-20(11-13-21)9-8-19-6-4-18(3)5-7-19/h4-7,10-13,26H,14-16H2,1-3H3
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2.70n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCdelta in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C beta type


(Homo sapiens (Human))
BDBM50249959
PNG
(CHEMBL522428 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C25H24O5/c1-17(2)22-14-25(15-26,30-24(22)28)16-29-23(27)21-12-10-20(11-13-21)9-8-19-6-4-18(3)5-7-19/h4-7,10-13,26H,14-16H2,1-3H3
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4.10n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCbeta in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50249959
PNG
(CHEMBL522428 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C25H24O5/c1-17(2)22-14-25(15-26,30-24(22)28)16-29-23(27)21-12-10-20(11-13-21)9-8-19-6-4-18(3)5-7-19/h4-7,10-13,26H,14-16H2,1-3H3
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5.40n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCdelta in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50249959
PNG
(CHEMBL522428 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C25H24O5/c1-17(2)22-14-25(15-26,30-24(22)28)16-29-23(27)21-12-10-20(11-13-21)9-8-19-6-4-18(3)5-7-19/h4-7,10-13,26H,14-16H2,1-3H3
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6n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCalpha in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C gamma type


(Homo sapiens (Human))
BDBM50249959
PNG
(CHEMBL522428 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C25H24O5/c1-17(2)22-14-25(15-26,30-24(22)28)16-29-23(27)21-12-10-20(11-13-21)9-8-19-6-4-18(3)5-7-19/h4-7,10-13,26H,14-16H2,1-3H3
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6.20n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCgamma in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C epsilon type


(Homo sapiens (Human))
BDBM50249959
PNG
(CHEMBL522428 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C25H24O5/c1-17(2)22-14-25(15-26,30-24(22)28)16-29-23(27)21-12-10-20(11-13-21)9-8-19-6-4-18(3)5-7-19/h4-7,10-13,26H,14-16H2,1-3H3
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8.30n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCepsilon in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C epsilon type


(Homo sapiens (Human))
BDBM50249959
PNG
(CHEMBL522428 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C25H24O5/c1-17(2)22-14-25(15-26,30-24(22)28)16-29-23(27)21-12-10-20(11-13-21)9-8-19-6-4-18(3)5-7-19/h4-7,10-13,26H,14-16H2,1-3H3
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10n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCepsilon in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50249958
PNG
(CHEMBL489520 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C28H30O6/c1-20(2)25-17-28(18-29,34-27(25)31)19-33-26(30)5-4-16-32-24-14-12-23(13-15-24)11-10-22-8-6-21(3)7-9-22/h6-9,12-15,29H,4-5,16-19H2,1-3H3
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12n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCdelta in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50249958
PNG
(CHEMBL489520 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C28H30O6/c1-20(2)25-17-28(18-29,34-27(25)31)19-33-26(30)5-4-16-32-24-14-12-23(13-15-24)11-10-22-8-6-21(3)7-9-22/h6-9,12-15,29H,4-5,16-19H2,1-3H3
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12n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCdelta in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C gamma type


(Homo sapiens (Human))
BDBM50249958
PNG
(CHEMBL489520 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C28H30O6/c1-20(2)25-17-28(18-29,34-27(25)31)19-33-26(30)5-4-16-32-24-14-12-23(13-15-24)11-10-22-8-6-21(3)7-9-22/h6-9,12-15,29H,4-5,16-19H2,1-3H3
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12n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCgamma in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C beta type


(Homo sapiens (Human))
BDBM50249959
PNG
(CHEMBL522428 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C25H24O5/c1-17(2)22-14-25(15-26,30-24(22)28)16-29-23(27)21-12-10-20(11-13-21)9-8-19-6-4-18(3)5-7-19/h4-7,10-13,26H,14-16H2,1-3H3
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13n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCbeta in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C beta type


(Homo sapiens (Human))
BDBM50249958
PNG
(CHEMBL489520 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C28H30O6/c1-20(2)25-17-28(18-29,34-27(25)31)19-33-26(30)5-4-16-32-24-14-12-23(13-15-24)11-10-22-8-6-21(3)7-9-22/h6-9,12-15,29H,4-5,16-19H2,1-3H3
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15n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCbeta in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50249959
PNG
(CHEMBL522428 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C25H24O5/c1-17(2)22-14-25(15-26,30-24(22)28)16-29-23(27)21-12-10-20(11-13-21)9-8-19-6-4-18(3)5-7-19/h4-7,10-13,26H,14-16H2,1-3H3
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16n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCalpha in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C gamma type


(Homo sapiens (Human))
BDBM50249959
PNG
(CHEMBL522428 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C25H24O5/c1-17(2)22-14-25(15-26,30-24(22)28)16-29-23(27)21-12-10-20(11-13-21)9-8-19-6-4-18(3)5-7-19/h4-7,10-13,26H,14-16H2,1-3H3
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16n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCgamma in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50249958
PNG
(CHEMBL489520 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C28H30O6/c1-20(2)25-17-28(18-29,34-27(25)31)19-33-26(30)5-4-16-32-24-14-12-23(13-15-24)11-10-22-8-6-21(3)7-9-22/h6-9,12-15,29H,4-5,16-19H2,1-3H3
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20n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCalpha in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50249885
PNG
(CHEMBL492118 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C27H28O6/c1-19(2)24-16-27(17-28,33-26(24)30)18-32-25(29)14-15-31-23-12-10-22(11-13-23)9-8-21-6-4-20(3)5-7-21/h4-7,10-13,28H,14-18H2,1-3H3
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21n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCalpha in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50249885
PNG
(CHEMBL492118 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C27H28O6/c1-19(2)24-16-27(17-28,33-26(24)30)18-32-25(29)14-15-31-23-12-10-22(11-13-23)9-8-21-6-4-20(3)5-7-21/h4-7,10-13,28H,14-18H2,1-3H3
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31n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCdelta in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C gamma type


(Homo sapiens (Human))
BDBM50249958
PNG
(CHEMBL489520 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C28H30O6/c1-20(2)25-17-28(18-29,34-27(25)31)19-33-26(30)5-4-16-32-24-14-12-23(13-15-24)11-10-22-8-6-21(3)7-9-22/h6-9,12-15,29H,4-5,16-19H2,1-3H3
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32n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCgamma in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C epsilon type


(Homo sapiens (Human))
BDBM50249958
PNG
(CHEMBL489520 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C28H30O6/c1-20(2)25-17-28(18-29,34-27(25)31)19-33-26(30)5-4-16-32-24-14-12-23(13-15-24)11-10-22-8-6-21(3)7-9-22/h6-9,12-15,29H,4-5,16-19H2,1-3H3
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32n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCepsilon in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C gamma type


(Homo sapiens (Human))
BDBM50249885
PNG
(CHEMBL492118 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C27H28O6/c1-19(2)24-16-27(17-28,33-26(24)30)18-32-25(29)14-15-31-23-12-10-22(11-13-23)9-8-21-6-4-20(3)5-7-21/h4-7,10-13,28H,14-18H2,1-3H3
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35n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCgamma in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50249885
PNG
(CHEMBL492118 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C27H28O6/c1-19(2)24-16-27(17-28,33-26(24)30)18-32-25(29)14-15-31-23-12-10-22(11-13-23)9-8-21-6-4-20(3)5-7-21/h4-7,10-13,28H,14-18H2,1-3H3
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36n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCdelta in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50249884
PNG
(CHEMBL523155 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C26H26O6/c1-18(2)23-14-26(16-27,32-25(23)29)17-31-24(28)15-30-22-12-10-21(11-13-22)9-8-20-6-4-19(3)5-7-20/h4-7,10-13,27H,14-17H2,1-3H3
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38n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCalpha in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C epsilon type


(Homo sapiens (Human))
BDBM50249958
PNG
(CHEMBL489520 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C28H30O6/c1-20(2)25-17-28(18-29,34-27(25)31)19-33-26(30)5-4-16-32-24-14-12-23(13-15-24)11-10-22-8-6-21(3)7-9-22/h6-9,12-15,29H,4-5,16-19H2,1-3H3
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38n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCepsilon in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C beta type


(Homo sapiens (Human))
BDBM50249958
PNG
(CHEMBL489520 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C28H30O6/c1-20(2)25-17-28(18-29,34-27(25)31)19-33-26(30)5-4-16-32-24-14-12-23(13-15-24)11-10-22-8-6-21(3)7-9-22/h6-9,12-15,29H,4-5,16-19H2,1-3H3
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44n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCbeta in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50249884
PNG
(CHEMBL523155 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C26H26O6/c1-18(2)23-14-26(16-27,32-25(23)29)17-31-24(28)15-30-22-12-10-21(11-13-22)9-8-20-6-4-19(3)5-7-20/h4-7,10-13,27H,14-17H2,1-3H3
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46n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCdelta in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50249884
PNG
(CHEMBL523155 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C26H26O6/c1-18(2)23-14-26(16-27,32-25(23)29)17-31-24(28)15-30-22-12-10-21(11-13-22)9-8-20-6-4-19(3)5-7-20/h4-7,10-13,27H,14-17H2,1-3H3
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48n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCdelta in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C gamma type


(Homo sapiens (Human))
BDBM50249884
PNG
(CHEMBL523155 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C26H26O6/c1-18(2)23-14-26(16-27,32-25(23)29)17-31-24(28)15-30-22-12-10-21(11-13-22)9-8-20-6-4-19(3)5-7-20/h4-7,10-13,27H,14-17H2,1-3H3
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51n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCgamma in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C beta type


(Homo sapiens (Human))
BDBM50249885
PNG
(CHEMBL492118 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C27H28O6/c1-19(2)24-16-27(17-28,33-26(24)30)18-32-25(29)14-15-31-23-12-10-22(11-13-23)9-8-21-6-4-20(3)5-7-21/h4-7,10-13,28H,14-18H2,1-3H3
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57n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCbeta in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C beta type


(Homo sapiens (Human))
BDBM50249885
PNG
(CHEMBL492118 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C27H28O6/c1-19(2)24-16-27(17-28,33-26(24)30)18-32-25(29)14-15-31-23-12-10-22(11-13-23)9-8-21-6-4-20(3)5-7-21/h4-7,10-13,28H,14-18H2,1-3H3
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66n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCbeta in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50249958
PNG
(CHEMBL489520 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C28H30O6/c1-20(2)25-17-28(18-29,34-27(25)31)19-33-26(30)5-4-16-32-24-14-12-23(13-15-24)11-10-22-8-6-21(3)7-9-22/h6-9,12-15,29H,4-5,16-19H2,1-3H3
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76n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCalpha in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C beta type


(Homo sapiens (Human))
BDBM50249884
PNG
(CHEMBL523155 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C26H26O6/c1-18(2)23-14-26(16-27,32-25(23)29)17-31-24(28)15-30-22-12-10-21(11-13-22)9-8-20-6-4-19(3)5-7-20/h4-7,10-13,27H,14-17H2,1-3H3
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76n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCbeta in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C gamma type


(Homo sapiens (Human))
BDBM50249885
PNG
(CHEMBL492118 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C27H28O6/c1-19(2)24-16-27(17-28,33-26(24)30)18-32-25(29)14-15-31-23-12-10-22(11-13-23)9-8-21-6-4-20(3)5-7-21/h4-7,10-13,28H,14-18H2,1-3H3
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78n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCgamma in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C epsilon type


(Homo sapiens (Human))
BDBM50249885
PNG
(CHEMBL492118 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C27H28O6/c1-19(2)24-16-27(17-28,33-26(24)30)18-32-25(29)14-15-31-23-12-10-22(11-13-23)9-8-21-6-4-20(3)5-7-21/h4-7,10-13,28H,14-18H2,1-3H3
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79n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCepsilon in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C beta type


(Homo sapiens (Human))
BDBM50249884
PNG
(CHEMBL523155 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C26H26O6/c1-18(2)23-14-26(16-27,32-25(23)29)17-31-24(28)15-30-22-12-10-21(11-13-22)9-8-20-6-4-19(3)5-7-20/h4-7,10-13,27H,14-17H2,1-3H3
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100n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCbeta in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C gamma type


(Homo sapiens (Human))
BDBM50249884
PNG
(CHEMBL523155 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C26H26O6/c1-18(2)23-14-26(16-27,32-25(23)29)17-31-24(28)15-30-22-12-10-21(11-13-22)9-8-20-6-4-19(3)5-7-20/h4-7,10-13,27H,14-17H2,1-3H3
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140n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCgamma in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50249885
PNG
(CHEMBL492118 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C27H28O6/c1-19(2)24-16-27(17-28,33-26(24)30)18-32-25(29)14-15-31-23-12-10-22(11-13-23)9-8-21-6-4-20(3)5-7-21/h4-7,10-13,28H,14-18H2,1-3H3
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143n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCalpha in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C epsilon type


(Homo sapiens (Human))
BDBM50249884
PNG
(CHEMBL523155 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C26H26O6/c1-18(2)23-14-26(16-27,32-25(23)29)17-31-24(28)15-30-22-12-10-21(11-13-22)9-8-20-6-4-19(3)5-7-20/h4-7,10-13,27H,14-17H2,1-3H3
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147n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCepsilon in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C epsilon type


(Homo sapiens (Human))
BDBM50249885
PNG
(CHEMBL492118 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C27H28O6/c1-19(2)24-16-27(17-28,33-26(24)30)18-32-25(29)14-15-31-23-12-10-22(11-13-23)9-8-21-6-4-20(3)5-7-21/h4-7,10-13,28H,14-18H2,1-3H3
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153n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCepsilon in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50249884
PNG
(CHEMBL523155 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C26H26O6/c1-18(2)23-14-26(16-27,32-25(23)29)17-31-24(28)15-30-22-12-10-21(11-13-22)9-8-20-6-4-19(3)5-7-20/h4-7,10-13,27H,14-17H2,1-3H3
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165n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCalpha in presence of plasma membrane lipid mimetic mixture


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair
Protein kinase C epsilon type


(Homo sapiens (Human))
BDBM50249884
PNG
(CHEMBL523155 | [2-(Hydroxymethyl)-4-(methylethylid...)
Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]C([#6]-[#8])([#6]-[#8]-[#6](=O)-[#6]-[#8]-c2ccc(cc2)C#Cc2ccc(-[#6])cc2)[#8]-[#6]-1=O
Show InChI InChI=1S/C26H26O6/c1-18(2)23-14-26(16-27,32-25(23)29)17-31-24(28)15-30-22-12-10-21(11-13-22)9-8-20-6-4-19(3)5-7-20/h4-7,10-13,27H,14-17H2,1-3H3
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Article
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268n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu form human PKCepsilon in presence of phosphatidylserine


J Med Chem 52: 3274-83 (2009)


Article DOI: 10.1021/jm900186m
BindingDB Entry DOI: 10.7270/Q2862GB6
More data for this
Ligand-Target Pair