Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetProstaglandin E synthase 2
LigandBDBM50168766
Substrate/Competitorn/a
Meas. Tech.ChEMBL_465385 (CHEMBL945933)
IC50>1000±n/a nM
Citation Côté, BBoulet, LBrideau, CClaveau, DEthier, DFrenette, RGagnon, MGiroux, AGuay, JGuiral, SMancini, JMartins, EMassé, FMéthot, NRiendeau, DRubin, JXu, DYu, HDucharme, YFriesen, RW Substituted phenanthrene imidazoles as potent, selective, and orally active mPGES-1 inhibitors. Bioorg Med Chem Lett17:6816-20 (2008) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Prostaglandin E synthase 2
Name:Prostaglandin E synthase 2
Synonyms:C9orf15 | PGES2 | PGES2_HUMAN | PTGES2
Type:Enzyme
Mol. Mass.:41955.21
Organism:Homo sapiens (Human)
Description:Q9H7Z7
Residue:377
Sequence:
MDPAARVVRALWPGGCALAWRLGGRPQPLLPTQSRAGFAGAAGGPSPVAAARKGSPRLLG
AAALALGGALGLYHTARWHLRAQDLHAERSAAQLSLSSRLQLTLYQYKTCPFCSKVRAFL
DFHALPYQVVEVNPVRRAEIKFSSYRKVPILVAQEGESSQQLNDSSVIISALKTYLVSGQ
PLEEIITYYPAMKAVNEQGKEVTEFGNKYWLMLNEKEAQQVYGGKEARTEEMKWRQWADD
WLVHLISPNVYRTPTEALASFDYIVREGKFGAVEGAVAKYMGAAAMYLISKRLKSRHRLQ
DNVREDLYEAADKWVAAVGKDRPFMGGQKPNLADLAVYGVLRVMEGLDAFDDLMQHTHIQ
PWYLRVERAITEASPAH
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50168766
n/a
NameBDBM50168766
Synonyms:3-(1-(4-chlorobenzyl)-5-(2-fluoro-2'-methylbiphenyl-4-yl)-3-methyl-1H-indol-2-yl)-2,2-dimethylpropanoic acid | 3-[1-(4-Chloro-benzyl)-5-(2-fluoro-2'-methyl-biphenyl-4-yl)-3-methyl-1H-indol-2-yl]-2,2-dimethyl-propionic acid | CHEMBL180650
TypeSmall organic molecule
Emp. Form.C34H31ClFNO2
Mol. Mass.540.067
SMILESCc1c(CC(C)(C)C(O)=O)n(Cc2ccc(Cl)cc2)c2ccc(cc12)-c1ccc(c(F)c1)-c1ccccc1C
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: