new BindingDB logo
myBDB logout

BDBM50425172 CHEMBL2313559

SMILES: C(N1CCCCC1)c1cc2ccc(Oc3nc4ccccc4s3)cc2o1

InChI Key: InChIKey=QPQWRRGUTIAUBL-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 = 50425172   
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
Leukotriene A4 hydrolase


(Homo sapiens (Human))
BDBM50425172
PNG
(CHEMBL2313559)
Show SMILES C(N1CCCCC1)c1cc2ccc(Oc3nc4ccccc4s3)cc2o1
Show InChI InChI=1S/C21H20N2O2S/c1-4-10-23(11-5-1)14-17-12-15-8-9-16(13-19(15)24-17)25-21-22-18-6-2-3-7-20(18)26-21/h2-3,6-9,12-13H,1,4-5,10-11,14H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 430n/an/an/an/an/an/a



Janssen Research& Development, LLC

Curated by ChEMBL


Assay Description
Inhibition of recombinant human LTA4H expressed in Sf9 cells using LTA4 as substrate incubated for 10 mins prior to substrate addition measured after...


Bioorg Med Chem Lett 23: 811-5 (2013)


Article DOI: 10.1016/j.bmcl.2012.11.074
BindingDB Entry DOI: 10.7270/Q27H1KW1
More data for this
Ligand-Target Pair