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BDBM50273789 6-Chloro-N-(naphthalen-2-yl)-2-(pyridin-3-yl)quinoline-4-carboxamide::CHEMBL455974

SMILES: Clc1ccc2nc(cc(C(=O)Nc3ccc4ccccc4c3)c2c1)-c1cccnc1

InChI Key: InChIKey=LTAVMGJPWSCBBM-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50273789   
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
Cytochrome P450 2C9


(Homo sapiens (Human))
BDBM50273789
PNG
(6-Chloro-N-(naphthalen-2-yl)-2-(pyridin-3-yl)quino...)
Show SMILES Clc1ccc2nc(cc(C(=O)Nc3ccc4ccccc4c3)c2c1)-c1cccnc1
Show InChI InChI=1S/C25H16ClN3O/c26-19-8-10-23-21(13-19)22(14-24(29-23)18-6-3-11-27-15-18)25(30)28-20-9-7-16-4-1-2-5-17(16)12-20/h1-15H,(H,28,30)
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
1.89E+3n/an/an/an/an/an/an/an/a



Washington State University

Curated by ChEMBL


Assay Description
Inhibition of reconstituted CYP2C9 (unknown origin)


J Med Chem 51: 8000-11 (2008)


Article DOI: 10.1021/jm8011257
BindingDB Entry DOI: 10.7270/Q2K937CZ
More data for this
Ligand-Target Pair