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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Protein kinase C beta type' and Ligand = 'BDBM50153448'   
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 beta type


(Homo sapiens (Human))
BDBM50153448
PNG
(3-(3-Chloro-phenylamino)-4-[1-(3-dimethylamino-pro...)
Show SMILES CN(C)CCCn1cc(C2=C(Nc3cccc(Cl)c3)C(=O)NC2=O)c2ccccc12 |c:9|
Show InChI InChI=1S/C23H23ClN4O2/c1-27(2)11-6-12-28-14-18(17-9-3-4-10-19(17)28)20-21(23(30)26-22(20)29)25-16-8-5-7-15(24)13-16/h3-5,7-10,13-14H,6,11-12H2,1-2H3,(H2,25,26,29,30)
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PC cid
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Article
PubMed
n/an/a 10n/an/an/an/an/an/a



Central Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against recombinant human Protein kinase C beta 2


Bioorg Med Chem Lett 14: 5171-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.061
BindingDB Entry DOI: 10.7270/Q2K35VDJ
More data for this
Ligand-Target Pair
Protein kinase C beta type


(Homo sapiens (Human))
BDBM50153448
PNG
(3-(3-Chloro-phenylamino)-4-[1-(3-dimethylamino-pro...)
Show SMILES CN(C)CCCn1cc(C2=C(Nc3cccc(Cl)c3)C(=O)NC2=O)c2ccccc12 |c:9|
Show InChI InChI=1S/C23H23ClN4O2/c1-27(2)11-6-12-28-14-18(17-9-3-4-10-19(17)28)20-21(23(30)26-22(20)29)25-16-8-5-7-15(24)13-16/h3-5,7-10,13-14H,6,11-12H2,1-2H3,(H2,25,26,29,30)
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Article
n/an/a 10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of PKCbeta2 (unknown origin)


Citation and Details

Article DOI: 10.1007/s00044-010-9439-6
BindingDB Entry DOI: 10.7270/Q2862KBF
More data for this
Ligand-Target Pair
Protein kinase C beta type


(Homo sapiens (Human))
BDBM50153448
PNG
(3-(3-Chloro-phenylamino)-4-[1-(3-dimethylamino-pro...)
Show SMILES CN(C)CCCn1cc(C2=C(Nc3cccc(Cl)c3)C(=O)NC2=O)c2ccccc12 |c:9|
Show InChI InChI=1S/C23H23ClN4O2/c1-27(2)11-6-12-28-14-18(17-9-3-4-10-19(17)28)20-21(23(30)26-22(20)29)25-16-8-5-7-15(24)13-16/h3-5,7-10,13-14H,6,11-12H2,1-2H3,(H2,25,26,29,30)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of PKCbeta2 (unknown origin)


Citation and Details

Article DOI: 10.1007/s00044-010-9439-6
BindingDB Entry DOI: 10.7270/Q2862KBF
More data for this
Ligand-Target Pair