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Target
Prostaglandin E synthase
Ligand
BDBM50443815
Substrate
n/a
Meas. Tech.
ChEMBL_1277572 (CHEMBL3096448)
IC50
700±n/a nM
Citation
 Hanke, T; Dehm, F; Liening, S; Popella, SD; Maczewsky, J; Pillong, M; Kunze, J; Weinigel, C; Barz, D; Kaiser, A; Wurglics, M; Lämmerhofer, M; Schneider, G; Sautebin, L; Schubert-Zsilavecz, M; Werz, O Aminothiazole-featured pirinixic acid derivatives as dual 5-lipoxygenase and microsomal prostaglandin E2 synthase-1 inhibitors with improved potency and efficiency in vivo. J Med Chem 56:9031-44 (2013) [PubMed]  Article 
Target
Name:
Prostaglandin E synthase
Synonyms:
Prostaglandin E2 synthase-1 ( mPGES-1) | Prostaglandin E synthase (PGES-1) | Prostaglandin E synthase 1 (mPGES-1) | Prostaglandin E synthase-1 (PGES-1) | PTGES_HUMAN | PTGES | MGST1L1 | MPGES1 | PGES | PIG12 | Prostaglandin E synthase/G/H synthase 2
Type:
Protein
Mol. Mass.:
17112.22
Organism:
Human
Description:
n/a
Residue:
152
Sequence:
MPAHSLVMSSPALPAFLLCSTLLVIKMYVVAIITGQVRLRKKAFANPEDALRHGGPQYCRSDPDVERCLRAHRNDMETIYPFLFLGFVYSFLGPNPFVAWMHFLVFLVGRVAHTVAYLGKLRAPIRSVTYTLAQLPCASMALQILWEAARHL
  
Inhibitor
Name:
BDBM50443815
Synonyms:
CHEMBL3094425
Type:
Small organic molecule
Emp. Form.:
C22H25ClN4O2S2
Mol. Mass.:
477.04
SMILES:
CCCCCCC(Sc1nc(Cl)cc(Nc2nc(c(C)s2)-c2ccccc2)n1)C(O)=O
Structure:
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