Reaction Details Report a problem with these data
Target
Prostaglandin E synthase
Ligand
BDBM50017557
Substrate
n/a
Meas. Tech.
ChEMBL_1363989 (CHEMBL3295576)
IC50
>50000±n/a nM
Citation
 Shang, E; Wu, Y; Liu, P; Liu, Y; Zhu, W; Deng, X; He, C; He, S; Li, C; Lai, L Benzo[d]isothiazole 1,1-dioxide derivatives as dual functional inhibitors of 5-lipoxygenase and microsomal prostaglandin E(2) synthase-1. Bioorg Med Chem Lett 24:2764-7 (2014) [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:
BDBM50017557
Synonyms:
CHEMBL3288314
Type:
Small organic molecule
Emp. Form.:
C14H11N3O4S
Mol. Mass.:
317.32
SMILES:
Cc1ccccc1NC1=NS(=O)(=O)c2cc(ccc12)[N+]([O-])=O |t:9|
Structure:
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