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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 = 'BDBM50311950'   
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))
BDBM50311950
PNG
(CHEMBL1081357 | N-sec-butyl-1-(4-(2-(5-cyano-4-(4-...)
Show SMILES CCC(C)NS(=O)(=O)Cc1ccc(\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)cc1
Show InChI InChI=1S/C28H29N5O2S/c1-4-19(2)33-36(34,35)18-22-7-5-21(6-8-22)9-10-23-16-30-17-24(15-29)28(23)32-26-11-12-27-25(20(26)3)13-14-31-27/h5-14,16-17,19,31,33H,4,18H2,1-3H3,(H,30,32)/b10-9+
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PC cid
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Article
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n/an/a 121n/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