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BDBM50135233 CHEMBL3746385

SMILES: COc1cc(\C=C\C(=O)OCCSc2nc(-c3ccc(cc3)S(C)(=O)=O)n(n2)-c2ccc(Br)cc2)ccc1OC(C)=O

InChI Key: InChIKey=QMNRIEXXZNKIEN-PJQLUOCWSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50135233   
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


(Rattus norvegicus)
BDBM50135233
PNG
(CHEMBL3746385)
Show SMILES COc1cc(\C=C\C(=O)OCCSc2nc(-c3ccc(cc3)S(C)(=O)=O)n(n2)-c2ccc(Br)cc2)ccc1OC(C)=O
Show InChI InChI=1S/C29H26BrN3O7S2/c1-19(34)40-25-14-4-20(18-26(25)38-2)5-15-27(35)39-16-17-41-29-31-28(21-6-12-24(13-7-21)42(3,36)37)33(32-29)23-10-8-22(30)9-11-23/h4-15,18H,16-17H2,1-3H3/b15-5+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 940n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in Sprague-Dawley rat leukocytes assessed as A23187 stimulated LTB4 production pretreated for 30 mins followed by addition of A23...


Eur J Med Chem 108: 89-103 (2016)


Article DOI: 10.1016/j.ejmech.2015.11.013
BindingDB Entry DOI: 10.7270/Q2X63PSS
More data for this
Ligand-Target Pair