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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclooxygenase-2' and Monomerid = 50246522   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM50246522
PNG
(1-(4-Aminosulfonylphenyl)-3-trifluoromethyl-5-[4-(...)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1nc(cc1-c1ccn(O)c(=O)c1)C(F)(F)F
Show InChI InChI=1S/C15H11F3N4O4S/c16-15(17,18)13-8-12(9-5-6-21(24)14(23)7-9)22(20-13)10-1-3-11(4-2-10)27(19,25)26/h1-8,24H,(H2,19,25,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.50E+3n/an/an/an/an/an/a



University of Alberta

Curated by ChEMBL


Assay Description
Inibition of ovine COX2 by enzyme immuno assay


Bioorg Med Chem Lett 18: 6138-41 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.009
BindingDB Entry DOI: 10.7270/Q2SF2W16
More data for this
Ligand-Target Pair