BindingDB logo
myBDB logout

BDBM50235089 2-((4-(2-(methylsulfonyl)ethoxy)-3-(2-phenylbicyclo[2.2.1]heptan-2-yl)phenoxy)methyl)quinoline::CHEMBL254547

SMILES: CS(=O)(=O)CCOc1ccc(OCc2ccc3ccccc3n2)cc1C1(CC2CCC1C2)c1ccccc1

InChI Key: InChIKey=KTRGTRZEBFKKCE-UHFFFAOYNA-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 = 50235089   
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
5-lipoxygenase/FLAP


(Homo sapiens (Human))
BDBM50235089
PNG
(2-((4-(2-(methylsulfonyl)ethoxy)-3-(2-phenylbicycl...)
Show SMILES CS(=O)(=O)CCOc1ccc(OCc2ccc3ccccc3n2)cc1C1(CC2CCC1C2)c1ccccc1
Show InChI InChI=1/C32H33NO4S/c1-38(34,35)18-17-36-31-16-15-28(37-22-27-14-12-24-7-5-6-10-30(24)33-27)20-29(31)32(25-8-3-2-4-9-25)21-23-11-13-26(32)19-23/h2-10,12,14-16,20,23,26H,11,13,17-19,21-22H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.5n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Displacement of [125I]L-691831 from FLAP


Bioorg Med Chem Lett 18: 2023-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.105
BindingDB Entry DOI: 10.7270/Q2CV4JKD
More data for this
Ligand-Target Pair