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DB00374 : treprostinil

Approved drug treprostinil ... 3 targets DB00374

Generic name: treprostinil
 
Brand name(s): remodulin, viveta.
Formula: C23H34O5
IUPAC Formula: 2-{[(1r,2r,3as,9as)-2-Hydroxy-1-[(3s)-3-Hydroxyoctyl]-1h,2h,3h,3ah,4h,9h,9ah-
Cyclopenta[b]naphthalen-5-Yl]oxy}acetic acid

3
There are 3 target proteins defined in DrugBank for this drug.
 2 
2 of these target proteins have one or more structures in the PDB.
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Target proteins

DrugBank drug Target 1:   UniProt id: P43119 (PI2R_HUMAN)  -  Prostacyclin receptor
UniProt id: P43119    386 a.a.  
 
There are no structures of the target protein in the PDB (click icon on left for list of closest matches)
DrugBank drug Target 2:   UniProt id: Q03181 (PPARD_HUMAN)  -  Peroxisome proliferator-activated receptor delta
UniProt id: Q03181    440 a.a.  
1. 3gwx A,B     271 a.a. 271   X-ray 2.40 Å
  2. 1gwx A,B     271 a.a. 271   X-ray 2.50 Å
  3. 3sp9 A,B     269 a.a. 269   X-ray 2.30 Å
  4. 3tkm A     270 a.a. 266   X-ray 1.95 Å
  5. 3et2 A,B     266 a.a. 266   X-ray 2.24 Å
   more ...
There are no PDB entries containing treprostinil bound to this target protein, although there are 23 entries of the target protein (click the orange, plus icon for a list).
DrugBank drug Target 3:   UniProt id: Q9H244 (P2Y12_HUMAN)  -  P2Y purinoceptor 12
UniProt id: Q9H244    341 a.a.  
1. 1t78 A     337 a.a. 336   Theor. model
  2. 1vz1 A     337 a.a. 336   Theor. model
  3. 1y9c A     302 a.a. 302   Theor. model
There are no PDB entries containing treprostinil 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  PfamB domain  Secondary structure  Bound drug molecule

 

 

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