KEGG   DRUG: Prucalopride
Entry
D09205                      Drug                                   
Name
Prucalopride (USAN/INN)
Formula
C18H26ClN3O3
Exact mass
367.1663
Mol weight
367.87
Structure
Class
Gastrointestinal agent
 DG01770  Laxative
Remark
ATC code: A06AX05
Chemical structure group: DG00080
Product (DG00080): D10152<US>
Efficacy
Prokinetic, Serotonin receptor agonist
Comment
Treatment of constipation
Target
HTR4 [HSA:3360] [KO:K04160]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04726  Serotonergic synapse
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A06 DRUGS FOR CONSTIPATION
   A06A DRUGS FOR CONSTIPATION
    A06AX Other drugs for constipation
     A06AX05 Prucalopride
      D09205  Prucalopride (USAN/INN)
Drug groups [BR:br08330]
 Gastrointestinal agent
  DG01770  Laxative
   DG00080  Prucalopride
    D09205  Prucalopride
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Serotonin
    HTR4
     D09205  Prucalopride (USAN/INN)
Drug groups [BR:br08330]
 Gastrointestinal agent
  DG01770  Laxative
   DG00080  Prucalopride
Other DBs
CAS: 179474-81-8
PubChem: 96025885
LigandBox: D09205
KCF data

ATOM        25
            1   C8y C    12.0400  -16.5200
            2   C8y C    12.0400  -15.1200
            3   C8y C    13.2300  -14.4200
            4   C8y C    14.4900  -15.1200
            5   C8y C    14.4900  -16.5200
            6   C8x C    13.2300  -17.2200
            7   C1x C    13.7900  -13.0200
            8   C1x C    15.1200  -13.0200
            9   O2x O    15.6100  -14.2800
            10  N1a N    10.7800  -14.4200
            11  X   Cl   10.7800  -17.2200
            12  C5a C    15.6800  -17.2900
            13  N1b N    16.9400  -16.5900
            14  O5a O    15.6800  -18.6900
            15  C1y C    18.1300  -17.2200
            16  C1x C    19.3200  -16.5900
            17  C1x C    20.5100  -17.2900
            18  N1y N    20.5100  -18.6900
            19  C1x C    19.3200  -19.3900
            20  C1x C    18.1300  -18.6900
            21  C1b C    21.7700  -19.3900
            22  C1b C    22.9600  -18.6900
            23  C1b C    24.1500  -19.3900
            24  O2a O    25.3400  -18.6900
            25  C1a C    26.5300  -19.3900
BOND        27
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     3   7 1
            8     7   8 1
            9     8   9 1
            10    4   9 1
            11    2  10 1
            12    1  11 1
            13    5  12 1
            14   12  13 1
            15   12  14 2
            16   13  15 1
            17   15  16 1
            18   16  17 1
            19   17  18 1
            20   18  19 1
            21   19  20 1
            22   15  20 1
            23   18  21 1
            24   21  22 1
            25   22  23 1
            26   23  24 1
            27   24  25 1

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Ontology (3)   
   KEGG BRITE (3)   
Drug (2)   
   KEGG DGROUP (1)   
   LigandBox (1)   
Chemical substance (1)   
   PubChem (1)   
Gene (2)   
   KEGG ORTHOLOGY (1)   
   KEGG GENES (1)   
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