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SMILES: COc1ccc(Nc2nc(cs2)-c2ccc(C)c(C)c2)cc1

InChI Key: InChIKey=IOMQXDDCAOSITN-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50382184   
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 G/H synthase 2


(Homo sapiens (Human))		BDBM50382184
PNG
(CHEMBL2023857)
Show SMILES COc1ccc(Nc2nc(cs2)-c2ccc(C)c(C)c2)cc1
Show InChI InChI=1S/C18H18N2OS/c1-12-4-5-14(10-13(12)2)17-11-22-18(20-17)19-15-6-8-16(21-3)9-7-15/h4-11H,1-3H3,(H,19,20)
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Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of COX2 by fluorescence assay

Bioorg Med Chem Lett 22: 3567-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.013
BindingDB Entry DOI: 10.7270/Q2RB75MP
More data for this
Ligand-Target Pair