KEGG   DRUG: Pergolide
Entry
D08339                      Drug                                   
Name
Pergolide (INN);
Permax (TN)
Formula
C19H26N2S
Exact mass
314.1817
Mol weight
314.49
Structure
Simcomp
Class
Neuropsychiatric agent
 DG01472  Dopamine agonist
 DG01964  Ergot alkaloid
 DG01967  Antiparkinson agent
Remark
Same as: C07425
ATC code: N04BC02
Chemical structure group: DG00861
Product (DG00861): D00502<JP>
Efficacy
Antiparkinsonian, Dopamine receptor agonist
Comment
Ergot alkaloid derivative
Target
DRD1 [HSA:1812] [KO:K04144]
DRD2 [HSA:1813] [KO:K04145]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04728  Dopaminergic synapse
hsa05012  Parkinson disease
Interaction
Structure map
map07057  Antiparkinsonian agents
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N04 ANTI-PARKINSON DRUGS
   N04B DOPAMINERGIC AGENTS
    N04BC Dopamine agonists
     N04BC02 Pergolide
      D08339  Pergolide (INN)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01472  Dopamine agonist
   DG00861  Pergolide
    D08339  Pergolide
  DG01964  Ergot alkaloid
   DG00861  Pergolide
    D08339  Pergolide
  DG01967  Antiparkinson agent
   DG00861  Pergolide
    D08339  Pergolide
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Dopamine
    DRD1
     D08339  Pergolide (INN)
    DRD2
     D08339  Pergolide (INN)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01472  Dopamine agonist
   DG00861  Pergolide
  DG01964  Ergot alkaloid
   DG00861  Pergolide
  DG01967  Antiparkinson agent
   DG00861  Pergolide
Other DBs
CAS: 66104-22-1
PubChem: 96025026
ChEBI: 63617
LigandBox: D08339
NIKKAJI: J19.083G
LinkDB
KCF data

ATOM        22
            1   C8y C    21.7700  -20.6500
            2   C8y C    21.7700  -19.2500
            3   C8y C    22.9600  -21.2800
            4   C8y C    20.5800  -21.2800
            5   C1y C    22.9600  -18.5500
            6   C8x C    20.6500  -18.5500
            7   C1x C    24.1500  -20.6500
            8   C8x C    22.9600  -22.6800
            9   N4x N    20.5800  -22.6800
            10  C8x C    19.4600  -20.5800
            11  C1y C    24.1500  -19.2500
            12  C1x C    22.9600  -17.2200
            13  C8x C    19.4600  -19.2500
            14  N1y N    25.3400  -18.6200
            15  C1y C    24.1500  -16.5200
            16  C1x C    25.3400  -17.2200
            17  C1b C    26.5300  -19.2500
            18  C1b C    24.1500  -15.1900
            19  C1b C    27.7200  -18.6200
            20  S2a S    25.3400  -14.4900
            21  C1a C    28.8400  -19.3200
            22  C1a C    25.3400  -13.1600
BOND        25
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     4  10 1
            10    5  11 1
            11    5  12 1
            12    6  13 1
            13   11  14 1
            14   12  15 1
            15   14  16 1
            16   14  17 1
            17   15  18 1 #Up
            18   17  19 1
            19   18  20 1
            20   19  21 1
            21   20  22 1
            22    7  11 1
            23    8   9 1
            24   10  13 2
            25   15  16 1

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