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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 = 'BDBM50311947'   
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))
BDBM50311947
PNG
(4-(2-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)pyrid...)
Show SMILES CCN(CC)S(=O)(=O)c1ccc(\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)cc1
Show InChI InChI=1S/C27H27N5O2S/c1-4-32(5-2)35(33,34)23-10-7-20(8-11-23)6-9-21-17-29-18-22(16-28)27(21)31-25-12-13-26-24(19(25)3)14-15-30-26/h6-15,17-18,30H,4-5H2,1-3H3,(H,29,31)/b9-6+
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MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 8.70n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 19: 6575-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.10.031
BindingDB Entry DOI: 10.7270/Q2KD1Z1F
More data for this
Ligand-Target Pair