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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 = 'BDBM50127653'   
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))		BDBM50127653
PNG
(1-(4-Methanesulfonyl-phenyl)-4,5-dihydro-3aH-napht...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C2C(CCc3ccccc23)OC1=O |t:11|
Show InChI InChI=1S/C19H16O4S/c1-24(21,22)14-9-6-13(7-10-14)17-18-15-5-3-2-4-12(15)8-11-16(18)23-19(17)20/h2-7,9-10,16H,8,11H2,1H3
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PubMed
n/an/a>4.50E+4n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity of the compound against recombinant human Prostaglandin G/H synthase 1

Bioorg Med Chem Lett 13: 1639-43 (2003)


BindingDB Entry DOI: 10.7270/Q2P26XHP
More data for this
Ligand-Target Pair