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BDBM50053566 4-{3-[7-(4,5-Dihydro-thiazol-2-yl)-5-furan-3-yl-naphthalen-2-yloxymethyl]-phenyl}-tetrahydro-pyran-4-ol::CHEMBL128300

SMILES: OC1(CCOCC1)c1cccc(COc2ccc3c(cc(cc3c2)C2=NCCS2)-c2ccoc2)c1

InChI Key: InChIKey=AFWQLFMODNHFNK-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50053566   
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
Arachidonate 5-lipoxygenase


(Homo sapiens (Human))
BDBM50053566
PNG
(4-{3-[7-(4,5-Dihydro-thiazol-2-yl)-5-furan-3-yl-na...)
Show SMILES OC1(CCOCC1)c1cccc(COc2ccc3c(cc(cc3c2)C2=NCCS2)-c2ccoc2)c1 |t:27|
Show InChI InChI=1S/C29H27NO4S/c31-29(7-11-32-12-8-29)24-3-1-2-20(14-24)18-34-25-4-5-26-22(16-25)15-23(28-30-9-13-35-28)17-27(26)21-6-10-33-19-21/h1-6,10,14-17,19,31H,7-9,11-13,18H2
PDB
MMDB

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PC cid
PC sid
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Article
PubMed
n/an/a 50n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Potency to inhibit oxidation of arachidonic acid by recombinant human 5-lipoxygenase


J Med Chem 39: 3951-70 (1996)


Article DOI: 10.1021/jm960301c
BindingDB Entry DOI: 10.7270/Q2639QCJ
More data for this
Ligand-Target Pair