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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Protein kinase C theta type' and Ligand = 'BDBM50313598'   
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 theta type


(Homo sapiens (Human))
BDBM50313598
PNG
((E)-5-(2-(6-((4-(2-hydroxyethyl)piperazin-1-yl)met...)
Show SMILES Cc1c(Nc2c(\C=C\c3cccc(CN4CCN(CCO)CC4)n3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C29H31N7O/c1-21-26-9-10-32-28(26)8-7-27(21)34-29-22(18-31-19-23(29)17-30)5-6-24-3-2-4-25(33-24)20-36-13-11-35(12-14-36)15-16-37/h2-10,18-19,32,37H,11-16,20H2,1H3,(H,31,34)/b6-5+
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Similars

Article
PubMed
n/an/a 0.650n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 20: 1965-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.119
BindingDB Entry DOI: 10.7270/Q2H70FX5
More data for this
Ligand-Target Pair