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Target
Prostaglandin E synthase
Ligand
BDBM50386166
Substrate
n/a
Meas. Tech.
ChEMBL_824647 (CHEMBL2045705)
IC50
>10000±n/a nM
Citation
 Chini, MG; De Simone, R; Bruno, I; Riccio, R; Dehm, F; Weinigel, C; Barz, D; Werz, O; Bifulco, G Design and synthesis of a second series of triazole-based compounds as potent dual mPGES-1 and 5-lipoxygenase inhibitors. Eur J Med Chem 54:311-23 (2012) [PubMed]  Article 
Target
Name:
Prostaglandin E synthase
Synonyms:
MGST1L1 | MPGES1 | PGES | PIG12 | PTGES | PTGES_HUMAN | Prostaglandin E synthase (PGES-1) | Prostaglandin E synthase 1 (mPGES-1) | Prostaglandin E synthase-1 (PGES-1) | Prostaglandin E synthase/G/H synthase 2 | Prostaglandin E2 synthase-1 ( mPGES-1)
Type:
Protein
Mol. Mass.:
17112.22
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
152
Sequence:
MPAHSLVMSSPALPAFLLCSTLLVIKMYVVAIITGQVRLRKKAFANPEDALRHGGPQYCRSDPDVERCLRAHRNDMETIYPFLFLGFVYSFLGPNPFVAWMHFLVFLVGRVAHTVAYLGKLRAPIRSVTYTLAQLPCASMALQILWEAARHL
  
Inhibitor
Name:
BDBM50386166
Synonyms:
CHEMBL2042364
Type:
Small organic molecule
Emp. Form.:
C23H16N4O6
Mol. Mass.:
444.3963
SMILES:
OC(=O)c1ccc(cc1)-c1ccc(cc1)-c1cn(Cc2ccc(cc2[N+]([O-])=O)C(O)=O)nn1
Structure:
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