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DB00494 : entacapone

Approved drug entacapone ... 1 target DB00494

Generic name: entacapone
 
Brand name(s): comtan, comtess.
Formula: C14H15N3O5
IUPAC Formula: (2e)-2-Cyano-3-(3,4-Dihydroxy-5-Nitrophenyl)-N,N-Diethylprop-2-Enamide

1
There is 1 target protein defined in DrugBank for this drug.
 1 
The target protein has one or more structures in the PDB.
Links  
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Target proteins

DrugBank drug Target 1:   UniProt id: P21964 (COMT_HUMAN)  -  Catechol O-methyltransferase
UniProt id: P21964    270 a.a.  
1. 3bwm A     214 a.a. 214   X-ray 1.98 Å
  2. 4pyk A     214 a.a. 214   X-ray 2.22 Å
  3. 3bwy A     214 a.a. 213   X-ray 1.30 Å
  4. 3a7e A     212 a.a. 212   X-ray 2.80 Å
  5. 4pyj A     208 a.a. 208   X-ray 1.90 Å
There are no PDB entries containing entacapone bound to this target protein, although there are 6 entries of the target protein (click the orange, plus icon for a list).

Key:    PfamA domain  Secondary structure  Bound drug molecule

The black crosses on the secondary structure diagrams indicate where the PDB and UniProt sequences differ.

 

 

Structure selection

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