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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclooxygenase-1 (COX-1)' and Ligand = 'BDBM50151759'   
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))
BDBM50151759
PNG
(6-Methanesulfonyl-3-(4-methoxy-phenoxy)-2-methyl-1...)
Show SMILES COc1ccc(Oc2c(C)[nH]c3cc(ccc23)S(C)(=O)=O)cc1
Show InChI InChI=1S/C17H17NO4S/c1-11-17(22-13-6-4-12(21-2)5-7-13)15-9-8-14(23(3,19)20)10-16(15)18-11/h4-10,18H,1-3H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.00E+3n/an/an/an/an/an/a



Roche Palo Alto

Curated by ChEMBL


Assay Description
Inhibitory concentration against human whole blood Prostaglandin G/H synthase 1 enzyme activity


Bioorg Med Chem Lett 14: 4741-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.075
BindingDB Entry DOI: 10.7270/Q228072S
More data for this
Ligand-Target Pair