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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Protein kinase C alpha type' and Ligand = 'BDBM50216860'   
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 alpha type


(MOUSE)
BDBM50216860
PNG
(CHEMBL230048 | Z-[2-(Hydroxymethyl)-4-(3-methylbut...)
Show SMILES CC(C)C\C=C1\CC(CO)(COC(=O)CC(CC(C)C)CC(C)C)OC1=O |w:7.9|
Show InChI InChI=1S/C22H38O5/c1-15(2)7-8-19-12-22(13-23,27-21(19)25)14-26-20(24)11-18(9-16(3)4)10-17(5)6/h8,15-18,23H,7,9-14H2,1-6H3/b19-8-
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Article
PubMed
3.07n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu from mouse recombinant PKCalpha expressed in Escherichia coli


J Med Chem 50: 3465-81 (2007)


Article DOI: 10.1021/jm0702579
BindingDB Entry DOI: 10.7270/Q2RF5TQ5
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50216860
PNG
(CHEMBL230048 | Z-[2-(Hydroxymethyl)-4-(3-methylbut...)
Show SMILES CC(C)C\C=C1\CC(CO)(COC(=O)CC(CC(C)C)CC(C)C)OC1=O |w:7.9|
Show InChI InChI=1S/C22H38O5/c1-15(2)7-8-19-12-22(13-23,27-21(19)25)14-26-20(24)11-18(9-16(3)4)10-17(5)6/h8,15-18,23H,7,9-14H2,1-6H3/b19-8-
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Article
PubMed
4.70n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [20-3H] phorbol 12, 13-dibutylate from recombinant PKCalpha (unknown origin) in presence of 100 ug/ml 100% phosphatidylserine


Eur J Med Chem 90: 332-41 (2015)


Article DOI: 10.1016/j.ejmech.2014.11.025
BindingDB Entry DOI: 10.7270/Q2930VV0
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50216860
PNG
(CHEMBL230048 | Z-[2-(Hydroxymethyl)-4-(3-methylbut...)
Show SMILES CC(C)C\C=C1\CC(CO)(COC(=O)CC(CC(C)C)CC(C)C)OC1=O |w:7.9|
Show InChI InChI=1S/C22H38O5/c1-15(2)7-8-19-12-22(13-23,27-21(19)25)14-26-20(24)11-18(9-16(3)4)10-17(5)6/h8,15-18,23H,7,9-14H2,1-6H3/b19-8-
PDB
MMDB

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KEGG

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PC sid
UniChem

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Article
PubMed
57n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [20-3H] phorbol 12, 13-dibutylate from recombinant PKCalpha (unknown origin) in presence of nuclear membrane mimetic lipid mixture


Eur J Med Chem 90: 332-41 (2015)


Article DOI: 10.1016/j.ejmech.2014.11.025
BindingDB Entry DOI: 10.7270/Q2930VV0
More data for this
Ligand-Target Pair