BindingDB logo
myBDB logout

BDBM50330101 4-(3-(pyridin-3-yl)-5-(trifluoromethyl)-1H-pyrazol-1-yl)-N-(pyridin-4-yl)benzamide::CHEMBL1271551

SMILES: FC(F)(F)c1cc(nn1-c1ccc(cc1)C(=O)Nc1ccncc1)-c1cccnc1

InChI Key: InChIKey=KPTZGFDAYXZNMA-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 = 50330101   
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
EBifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50330101
PNG
(4-(3-(pyridin-3-yl)-5-(trifluoromethyl)-1H-pyrazol...)
Show SMILES FC(F)(F)c1cc(nn1-c1ccc(cc1)C(=O)Nc1ccncc1)-c1cccnc1
Show InChI InChI=1S/C21H14F3N5O/c22-21(23,24)19-12-18(15-2-1-9-26-13-15)28-29(19)17-5-3-14(4-6-17)20(30)27-16-7-10-25-11-8-16/h1-13H,(H,25,27,30)
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/a 450n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of human Ephx2 after 30 mins by fluorescence polarization assay


Bioorg Med Chem Lett 20: 6379-83 (2010)


Article DOI: 10.1016/j.bmcl.2010.09.095
BindingDB Entry DOI: 10.7270/Q2V69JT7
More data for this
Ligand-Target Pair