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BDBM50374189 CHEMBL441897

SMILES: CC(C)[C@@H]1N(C)c2ccc3c(C)nn4cc(C[C@@H](CO)NC1=O)c2c34

InChI Key: InChIKey=IYKCWOIZNVHUMI-GUYCJALGSA-N

Data: 10 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 10 hits for monomerid = 50374189   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50374189
PNG
(CHEMBL441897)
Show SMILES CC(C)[C@@H]1N(C)c2ccc3c(C)nn4cc(C[C@@H](CO)NC1=O)c2c34
Show InChI InChI=1S/C19H24N4O2/c1-10(2)17-19(25)20-13(9-24)7-12-8-23-18-14(11(3)21-23)5-6-15(16(12)18)22(17)4/h5-6,8,10,13,17,24H,7,9H2,1-4H3,(H,20,25)/t13-,17-/m0/s1
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Article
PubMed
128n/an/an/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu from PKCdelta C1B domain


Bioorg Med Chem 16: 650-7 (2008)


Article DOI: 10.1016/j.bmc.2007.10.045
BindingDB Entry DOI: 10.7270/Q2XS5W85
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50374189
PNG
(CHEMBL441897)
Show SMILES CC(C)[C@@H]1N(C)c2ccc3c(C)nn4cc(C[C@@H](CO)NC1=O)c2c34
Show InChI InChI=1S/C19H24N4O2/c1-10(2)17-19(25)20-13(9-24)7-12-8-23-18-14(11(3)21-23)5-6-15(16(12)18)22(17)4/h5-6,8,10,13,17,24H,7,9H2,1-4H3,(H,20,25)/t13-,17-/m0/s1
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149n/an/an/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu from PKCtheta C1B domain


Bioorg Med Chem 16: 650-7 (2008)


Article DOI: 10.1016/j.bmc.2007.10.045
BindingDB Entry DOI: 10.7270/Q2XS5W85
More data for this
Ligand-Target Pair
Protein kinase C, eta


(Homo sapiens (Human))
BDBM50374189
PNG
(CHEMBL441897)
Show SMILES CC(C)[C@@H]1N(C)c2ccc3c(C)nn4cc(C[C@@H](CO)NC1=O)c2c34
Show InChI InChI=1S/C19H24N4O2/c1-10(2)17-19(25)20-13(9-24)7-12-8-23-18-14(11(3)21-23)5-6-15(16(12)18)22(17)4/h5-6,8,10,13,17,24H,7,9H2,1-4H3,(H,20,25)/t13-,17-/m0/s1
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223n/an/an/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu from PKCeta C1B domain


Bioorg Med Chem 16: 650-7 (2008)


Article DOI: 10.1016/j.bmc.2007.10.045
BindingDB Entry DOI: 10.7270/Q2XS5W85
More data for this
Ligand-Target Pair
Protein kinase C, epsilon


(Homo sapiens (Human))
BDBM50374189
PNG
(CHEMBL441897)
Show SMILES CC(C)[C@@H]1N(C)c2ccc3c(C)nn4cc(C[C@@H](CO)NC1=O)c2c34
Show InChI InChI=1S/C19H24N4O2/c1-10(2)17-19(25)20-13(9-24)7-12-8-23-18-14(11(3)21-23)5-6-15(16(12)18)22(17)4/h5-6,8,10,13,17,24H,7,9H2,1-4H3,(H,20,25)/t13-,17-/m0/s1
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407n/an/an/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu from PKCepsilon C1B domain


Bioorg Med Chem 16: 650-7 (2008)


Article DOI: 10.1016/j.bmc.2007.10.045
BindingDB Entry DOI: 10.7270/Q2XS5W85
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50374189
PNG
(CHEMBL441897)
Show SMILES CC(C)[C@@H]1N(C)c2ccc3c(C)nn4cc(C[C@@H](CO)NC1=O)c2c34
Show InChI InChI=1S/C19H24N4O2/c1-10(2)17-19(25)20-13(9-24)7-12-8-23-18-14(11(3)21-23)5-6-15(16(12)18)22(17)4/h5-6,8,10,13,17,24H,7,9H2,1-4H3,(H,20,25)/t13-,17-/m0/s1
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1.09E+3n/an/an/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu from PKCalpha C1A domain


Bioorg Med Chem 16: 650-7 (2008)


Article DOI: 10.1016/j.bmc.2007.10.045
BindingDB Entry DOI: 10.7270/Q2XS5W85
More data for this
Ligand-Target Pair
PKC alpha and beta-2


(Homo sapiens (Human))
BDBM50374189
PNG
(CHEMBL441897)
Show SMILES CC(C)[C@@H]1N(C)c2ccc3c(C)nn4cc(C[C@@H](CO)NC1=O)c2c34
Show InChI InChI=1S/C19H24N4O2/c1-10(2)17-19(25)20-13(9-24)7-12-8-23-18-14(11(3)21-23)5-6-15(16(12)18)22(17)4/h5-6,8,10,13,17,24H,7,9H2,1-4H3,(H,20,25)/t13-,17-/m0/s1
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PubMed
1.10E+3n/an/an/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu from PKCbeta C1A domain


Bioorg Med Chem 16: 650-7 (2008)


Article DOI: 10.1016/j.bmc.2007.10.045
BindingDB Entry DOI: 10.7270/Q2XS5W85
More data for this
Ligand-Target Pair
Protein kinase C, gamma


(Homo sapiens (Human))
BDBM50374189
PNG
(CHEMBL441897)
Show SMILES CC(C)[C@@H]1N(C)c2ccc3c(C)nn4cc(C[C@@H](CO)NC1=O)c2c34
Show InChI InChI=1S/C19H24N4O2/c1-10(2)17-19(25)20-13(9-24)7-12-8-23-18-14(11(3)21-23)5-6-15(16(12)18)22(17)4/h5-6,8,10,13,17,24H,7,9H2,1-4H3,(H,20,25)/t13-,17-/m0/s1
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1.51E+3n/an/an/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu from PKCgamma C1A domain


Bioorg Med Chem 16: 650-7 (2008)


Article DOI: 10.1016/j.bmc.2007.10.045
BindingDB Entry DOI: 10.7270/Q2XS5W85
More data for this
Ligand-Target Pair
Protein kinase C, gamma


(Homo sapiens (Human))
BDBM50374189
PNG
(CHEMBL441897)
Show SMILES CC(C)[C@@H]1N(C)c2ccc3c(C)nn4cc(C[C@@H](CO)NC1=O)c2c34
Show InChI InChI=1S/C19H24N4O2/c1-10(2)17-19(25)20-13(9-24)7-12-8-23-18-14(11(3)21-23)5-6-15(16(12)18)22(17)4/h5-6,8,10,13,17,24H,7,9H2,1-4H3,(H,20,25)/t13-,17-/m0/s1
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2.58E+3n/an/an/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu from PKCgamma C1B domain


Bioorg Med Chem 16: 650-7 (2008)


Article DOI: 10.1016/j.bmc.2007.10.045
BindingDB Entry DOI: 10.7270/Q2XS5W85
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50374189
PNG
(CHEMBL441897)
Show SMILES CC(C)[C@@H]1N(C)c2ccc3c(C)nn4cc(C[C@@H](CO)NC1=O)c2c34
Show InChI InChI=1S/C19H24N4O2/c1-10(2)17-19(25)20-13(9-24)7-12-8-23-18-14(11(3)21-23)5-6-15(16(12)18)22(17)4/h5-6,8,10,13,17,24H,7,9H2,1-4H3,(H,20,25)/t13-,17-/m0/s1
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2.62E+3n/an/an/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu from PKCalpha C1B domain


Bioorg Med Chem 16: 650-7 (2008)


Article DOI: 10.1016/j.bmc.2007.10.045
BindingDB Entry DOI: 10.7270/Q2XS5W85
More data for this
Ligand-Target Pair
PKC alpha and beta-2


(Homo sapiens (Human))
BDBM50374189
PNG
(CHEMBL441897)
Show SMILES CC(C)[C@@H]1N(C)c2ccc3c(C)nn4cc(C[C@@H](CO)NC1=O)c2c34
Show InChI InChI=1S/C19H24N4O2/c1-10(2)17-19(25)20-13(9-24)7-12-8-23-18-14(11(3)21-23)5-6-15(16(12)18)22(17)4/h5-6,8,10,13,17,24H,7,9H2,1-4H3,(H,20,25)/t13-,17-/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu from PKCbeta C1B domain


Bioorg Med Chem 16: 650-7 (2008)


Article DOI: 10.1016/j.bmc.2007.10.045
BindingDB Entry DOI: 10.7270/Q2XS5W85
More data for this
Ligand-Target Pair