new BindingDB logo
myBDB logout

BDBM50166598 CHEMBL3799237

SMILES: CCN1c2cc(ccc2C(=O)NC1(C)C)-c1c(C)n[nH]c1C

InChI Key: InChIKey=DUTODZZHAPKLHS-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50166598   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM50166598
PNG
(CHEMBL3799237)
Show SMILES CCN1c2cc(ccc2C(=O)NC1(C)C)-c1c(C)n[nH]c1C
Show InChI InChI=1S/C17H22N4O/c1-6-21-14-9-12(15-10(2)19-20-11(15)3)7-8-13(14)16(22)18-17(21,4)5/h7-9H,6H2,1-5H3,(H,18,22)(H,19,20)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.90E+3n/an/an/an/an/an/a



Takeda Pharmaceutical Company, Ltd

Curated by ChEMBL


Assay Description
Inhibition of N-terminal FLAG-tagged PKCtheta (unknown origin) expressed in baculovirus preincubated for 5 mins using fluorescein-PKC substrate measu...


Bioorg Med Chem 24: 2466-75 (2016)

More data for this
Ligand-Target Pair