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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 = 'BDBM50049627'   
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


(Homo sapiens (Human))
BDBM50049627
PNG
(4,3',4',5',6'-Pentafluoro-4''-methanesulfonyl-[1,1...)
Show SMILES CS(=O)(=O)c1ccc(cc1)-c1c(F)c(F)c(F)c(F)c1-c1ccc(F)cc1
Show InChI InChI=1S/C19H11F5O2S/c1-27(25,26)13-8-4-11(5-9-13)15-14(10-2-6-12(20)7-3-10)16(21)18(23)19(24)17(15)22/h2-9H,1H3
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Patents


Similars

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



Searle Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against human recombinant prostaglandin G/H synthase 1.


J Med Chem 39: 1846-56 (1996)


Article DOI: 10.1021/jm950878e
BindingDB Entry DOI: 10.7270/Q2Z89BGW
More data for this
Ligand-Target Pair