Reaction Details Report a problem with these data
Target
Prostaglandin E synthase
Ligand
BDBM197578
Substrate
n/a
Meas. Tech.
Inhibition Assay
IC50
1.20±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:
BDBM197578
Synonyms:
US9216968, 178 | US9732066, 178
Type:
Small organic molecule
Emp. Form.:
C26H23ClF3N5O2S
Mol. Mass.:
562.006
SMILES:
CSCCNc1nc2c(cc(NC(=O)c3ccccc3C(F)(F)F)cc2[nH]1)C(=O)Nc1cccc(Cl)c1C
Structure:
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