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Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 2' and Ligand = 'BDBM50112535'   
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 2


(Homo sapiens (Human))
BDBM50112535
PNG
(2-[1-(4-Chloro-benzoyl)-5-methoxy-2-methyl-1H-indo...)
Show SMILES CCC(C)[C@@H](CO)NC(=O)Cc1c(C)n(C(=O)c2ccc(Cl)cc2)c2ccc(OC)cc12
Show InChI InChI=1S/C25H29ClN2O4/c1-5-15(2)22(14-29)27-24(30)13-20-16(3)28(23-11-10-19(32-4)12-21(20)23)25(31)17-6-8-18(26)9-7-17/h6-12,15,22,29H,5,13-14H2,1-4H3,(H,27,30)/t15?,22-/m1/s1
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PubMed
n/an/a 110n/an/an/an/an/an/a



Vanderbilt University School of Medicine

Curated by ChEMBL


Assay Description
Inhibitory concentration against human prostaglandin G/H synthase 2


Bioorg Med Chem Lett 12: 1315-8 (2002)


BindingDB Entry DOI: 10.7270/Q2S75FNZ
More data for this
Ligand-Target Pair