BindingDB logo
myBDB logout

BDBM50249706 3-acetyl-6,8-difluoro-2-(2,4,5-trifluorophenylamino)quinolin-4(1H)-one::CHEMBL489728

SMILES: CC(=O)c1c(Nc2cc(F)c(F)cc2F)nc2c(F)cc(F)cc2c1O

InChI Key: InChIKey=JTLXPFQOLMZPDA-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 = 50249706   
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
Calpain1/2


(Homo sapiens (Human))
BDBM50249706
PNG
(3-acetyl-6,8-difluoro-2-(2,4,5-trifluorophenylamin...)
Show SMILES CC(=O)c1c(Nc2cc(F)c(F)cc2F)nc2c(F)cc(F)cc2c1O
Show InChI InChI=1S/C17H9F5N2O2/c1-6(25)14-16(26)8-2-7(18)3-12(22)15(8)24-17(14)23-13-5-10(20)9(19)4-11(13)21/h2-5H,1H3,(H2,23,24,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human erythrocytes mu-calpain after 30 mins by fluorometric assay using pep1 as substrate


J Med Chem 52: 3093-7 (2009)


Article DOI: 10.1021/jm8014734
BindingDB Entry DOI: 10.7270/Q2KK9CQ4
More data for this
Ligand-Target Pair