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Target
Prostaglandin E synthase
Ligand
BDBM50114552
Substrate
n/a
Meas. Tech.
ChEMBL_1513802 (CHEMBL3611120)
IC50
610±n/a nM
Citation
 Wiechmann, K; Müller, H; Huch, V; Hartmann, D; Werz, O; Jauch, J Synthesis and biological evaluation of novel myrtucommulones and structural analogues that target mPGES-1 and 5-lipoxygenase. Eur J Med Chem 101:133-49 (2015) [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:
BDBM50114552
Synonyms:
CHEMBL3608368
Type:
Small organic molecule
Emp. Form.:
C40H54O9
Mol. Mass.:
678.8514
SMILES:
CCCCCC(=O)c1c(O)c(C(C(C)C)C2=C(O)C(C)(C)C(=O)C(C)(C)C2=O)c(O)c2C(C(C)C)C3=C(Oc12)C(C)(C)C(=O)C(C)(C)C3=O |c:15,36|
Structure:
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