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Target
Prostaglandin E synthase
Ligand
BDBM50424303
Substrate
n/a
Meas. Tech.
ChEMBL_935039 (CHEMBL2320904)
IC50
12900±n/a nM
Citation
 Lee, K; Pham, VC; Choi, MJ; Kim, KJ; Lee, KT; Han, SG; Yu, YG; Lee, JY Fragment-based discovery of novel and selective mPGES-1 inhibitors Part 1: identification of sulfonamido-1,2,3-triazole-4,5-dicarboxylic acid. Bioorg Med Chem Lett 23:75-80 (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:
BDBM50424303
Synonyms:
CHEMBL2314490
Type:
Small organic molecule
Emp. Form.:
C14H16N4O6S
Mol. Mass.:
368.365
SMILES:
COC(=O)c1nnn(CCNS(=O)(=O)c2ccccc2)c1C(=O)OC
Structure:
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