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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclooxygenase-2' and Monomerid = 50303135   
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))
BDBM50303135
PNG
((7S,8R,2'R,3'S,5'R)-Delta(8')-2'-hydroxy-5,5'-dime...)
Show SMILES COc1cc(cc2OCOc12)[C@@H]1[C@@H](C)[C@@]2(OC)C=C(CC=C)[C@H](O)[C@]1(OC)C2=O
Show InChI InChI=1S/C22H26O7/c1-6-7-13-10-21(26-4)12(2)17(22(27-5,19(13)23)20(21)24)14-8-15(25-3)18-16(9-14)28-11-29-18/h6,8-10,12,17,19,23H,1,7,11H2,2-5H3/t12-,17+,19+,21+,22+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 9.21E+4n/an/an/an/an/an/a



Universidad Nacional de Colombia

Curated by ChEMBL


Assay Description
Inhibition of ovine COX-2 assessed as inhibition of transformation of AA to PGH2 by EIA


Bioorg Med Chem Lett 19: 6922-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.10.069
BindingDB Entry DOI: 10.7270/Q2J1043X
More data for this
Ligand-Target Pair