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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 1' and Ligand = 'BDBM50105287'   
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 1


(RAT)
BDBM50105287
PNG
(2-[4-(4-Chloro-benzyl)-7-methanesulfonyl-naphthale...)
Show SMILES CC(C(O)=O)c1ccc(Cc2ccc(Cl)cc2)c2ccc(cc12)S(C)(=O)=O
Show InChI InChI=1S/C21H19ClO4S/c1-13(21(23)24)18-9-5-15(11-14-3-6-16(22)7-4-14)19-10-8-17(12-20(18)19)27(2,25)26/h3-10,12-13H,11H2,1-2H3,(H,23,24)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against rat prostaglandin G/H synthase 1


Bioorg Med Chem Lett 11: 2687-90 (2001)


BindingDB Entry DOI: 10.7270/Q2BC3XV1
More data for this
Ligand-Target Pair