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BDBM50401458 CHEMBL2204546

SMILES: Cc1cccc2c1oc(nc2=O)N(Cc1ccccn1)c1cccnc1

InChI Key: InChIKey=NGRBZYSCYZCFKF-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 = 50401458   
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
DNA-dependent protein kinase


(Homo sapiens (Human))
BDBM50401458
PNG
(CHEMBL2204546)
Show SMILES Cc1cccc2c1oc(nc2=O)N(Cc1ccccn1)c1cccnc1
Show InChI InChI=1S/C20H16N4O2/c1-14-6-4-9-17-18(14)26-20(23-19(17)25)24(16-8-5-10-21-12-16)13-15-7-2-3-11-22-15/h2-12H,13H2,1H3
PDB

KEGG

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.52E+4n/an/an/an/an/an/a



La Trobe University

Curated by ChEMBL


Assay Description
Inhibition of DNA-PK using EPPLSQEAFADLWKK as substrate after 5 mins by ADP-Glo kinase assay


Eur J Med Chem 57: 85-101 (2012)


Article DOI: 10.1016/j.ejmech.2012.08.035
BindingDB Entry DOI: 10.7270/Q2XS5WK6
More data for this
Ligand-Target Pair