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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclooxygenase-1' and Monomerid = 50091189   
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
Cyclooxygenase-1 (COX-1)


(Homo sapiens (Human))
BDBM50091189
PNG
(4-[2-(5-Methyl-isoxazol-3-yl)-4-trifluoromethyl-im...)
Show SMILES Cc1cc(no1)-c1nc(cn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F
Show InChI InChI=1S/C14H11F3N4O3S/c1-8-6-11(20-24-8)13-19-12(14(15,16)17)7-21(13)9-2-4-10(5-3-9)25(18,22)23/h2-7H,1H3,(H2,18,22,23)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Prostaglandin G/H synthase 1


J Med Chem 43: 3168-85 (2000)


Article DOI: 10.1021/jm0000719
BindingDB Entry DOI: 10.7270/Q2513XG3
More data for this
Ligand-Target Pair