Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetProstaglandin E synthase
LigandBDBM451699
Substrate/Competitorn/a
Meas. Tech.Inhibitory Activity Assay
IC50<1.000±n/a nM
Citation Okada, MNakano, YNose, TNishimoto, TMaeda, S Pyrimidine derivative US Patent US10710967 Publication Date 7/14/2020
More Info.:Get all data from this article,  Assay Method
 
Prostaglandin E synthase
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:
MPAHSLVMSSPALPAFLLCSTLLVIKMYVVAIITGQVRLRKKAFANPEDALRHGGPQYCR
SDPDVERCLRAHRNDMETIYPFLFLGFVYSFLGPNPFVAWMHFLVFLVGRVAHTVAYLGK
LRAPIRSVTYTLAQLPCASMALQILWEAARHL
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM451699
n/a
NameBDBM451699
Synonyms:US10710967, Example 294
TypeSmall organic molecule
Emp. Form.C25H22F2N4O2
Mol. Mass.448.4646
SMILESCC(C)C(=O)NCc1ccc(F)c(c1F)-c1nc(cc(=O)[nH]1)-c1ccc(cn1)C#CC1CC1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: