Reaction Details Report a problem with these data
Target
Prostaglandin E synthase
Ligand
BDBM197535
Substrate
n/a
Meas. Tech.
Inhibition Assay
IC50
0.300±n/a nM
Citation
 Otsu, H Heterocyclic derivative and pharmaceutical drug US Patent  US9732066 Publication Date 8/15/2017 
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:
BDBM197535
Synonyms:
US9216968, 135 | US9732066, 135
Type:
Small organic molecule
Emp. Form.:
C23H15Cl2F3N4O2
Mol. Mass.:
507.292
SMILES:
Cc1c(Cl)cccc1NC(=O)c1cc(NC(=O)c2ccccc2C(F)(F)F)cc2[nH]c(Cl)nc12
Structure:
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