KEGG   DRUG: D09397Help
Entry
D09397                      Drug                                   

Name
Pardoprunox (USAN/INN)
Formula
C12H15N3O2
Exact mass
233.1164
Mol weight
233.2664
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Parkinson's disease, restless legs syndrome
Remark
Drug group: 
Target
dopamine D2-receptor partial agonist [HSA:1813] [KO:K04145];
dopamine D3-receptor partial agonist [HSA:1814] [KO:K04146];
5-HT1A-receptor agonist [HSA:3350] [KO:K04153]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04726  Serotonergic synapse
hsa04728  Dopaminergic synapse  
 
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Dopamine
    dopamine D2-receptor
     Pardoprunox
      D09397  Pardoprunox (USAN/INN)
    dopamine D3-receptor
     Pardoprunox
      D09397  Pardoprunox (USAN/INN)
   Serotonin
    5-HT1A-receptor
     Pardoprunox
      D09397  Pardoprunox (USAN/INN)
BRITE hierarchy
Other DBs
PubChem: 
LigandBox: 
KCF data Show

ATOM        17
            1   C1x C    20.5800  -22.8200
            2   N1y N    20.5800  -21.4200
            3   C1x C    21.8400  -20.7200
            4   C1x C    23.0300  -21.4200
            5   N1y N    23.0300  -22.8200
            6   C1x C    21.8400  -23.5200
            7   C8y C    24.2900  -23.5200
            8   C8y C    25.4800  -22.8200
            9   C8y C    26.6700  -23.5200
            10  C8x C    26.6700  -24.9200
            11  C8x C    25.4800  -25.6200
            12  C8x C    24.2900  -24.9200
            13  O7x O    25.7600  -21.4200
            14  C8y C    27.1600  -21.2800
            15  N4x N    27.7200  -22.5400
            16  O6a O    27.8600  -20.0900
            17  C1a C    19.3900  -20.7200
BOND        19
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     5   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11   10  11 2
            12   11  12 1
            13    7  12 2
            14    8  13 1
            15   13  14 1
            16   14  15 1
            17    9  15 1
            18   14  16 2
            19    2  17 1

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