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SMILES: COc1ccc(C\C=C\CCCCc2ccc(O)cc2)cc1OC

InChI Key: InChIKey=WEUBYUXOOVDPJD-FNORWQNLSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50453466   
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
Prostaglandin E synthase


(Mus musculus)		BDBM50453466
PNG
(CHEMBL4218509)
Show SMILES COc1ccc(C\C=C\CCCCc2ccc(O)cc2)cc1OC
Show InChI InChI=1S/C21H26O3/c1-23-20-15-12-18(16-21(20)24-2)9-7-5-3-4-6-8-17-10-13-19(22)14-11-17/h5,7,10-16,22H,3-4,6,8-9H2,1-2H3/b7-5+
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.70E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mPGES1 in mouse 3T3L1 cells assessed as reduction in PGE2 production after 1 hr by ELISA

Citation and Details

Article DOI: 10.1016/j.bmcl.2017.12.046
BindingDB Entry DOI: 10.7270/Q23B62QH
More data for this
Ligand-Target Pair