KEGG   DRUG: Haloperidol decanoateHelp
Entry
D01898                      Drug                                   

Name
Haloperidol decanoate (JAN/USAN);
Halomonth (TN)
Product
  Generic
Formula
C31H41ClFNO3
Exact mass
529.2759
Mol weight
530.1135
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Class
Neuropsychiatric agent
 DG01940  Butyrophenone derivative
 DG01478  Dopamine antagonist
  DG01474  Dopamine D2-receptor antagonist
Cyp substrate
 DG01892  CYP1A2 substrate
 DG01644  CYP2D6 substrate
 DG01633  CYP3A substrate
Remark
Therapeutic category: 
ATC code: 
Chemical group: 
Activity
Antipsychotic, Neuroleptic, Dopamine D2 receptor antagonist
Comment
Butyrophenone derivative
Active form of prodrug: Haloperidol [DR:D00136]
Target
DRD2 [HSA:1813] [KO:K04145]
  Pathway
Neuroactive ligand-receptor interaction
Gap junction
Metabolism
Enzyme: CYP2D6 [HSA:1565], CYP3A4 [HSA:1576], CYP3A5 [HSA:1577], CYP3A7 [HSA:1551], CYP1A2 [HSA:1544]
Interaction
Drug interaction
Structure map
Butyrophenones
Dopamine receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N05 PSYCHOLEPTICS
   N05A ANTIPSYCHOTICS
    N05AD Butyrophenone derivatives
     N05AD01 Haloperidol
      D01898  Haloperidol decanoate (JAN/USAN)
USP drug classification [BR:br08302]
 Antipsychotics
  1st Generation/Typical
   Haloperidol
    D01898  Haloperidol decanoate (JAN/USAN)
Therapeutic category of drugs in Japan [BR:br08301]
 1  Agents affecting nervous system and sensory organs
  11  Agents affecting central nervous system
   117  Psychotropics
    1179  Others
     D01898  Haloperidol decanoate (JAN/USAN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Dopamine
    dopamine D2-receptor
     Haloperidol
      D01898  Haloperidol decanoate (JAN/USAN)
Cytochrome P450 interactions [BR:br08309]
 CYP substrates
  CYP1A2
   Haloperidol
    D01898  Haloperidol decanoate (JAN/USAN)
  CYP2D6
   Haloperidol
    D01898  Haloperidol decanoate (JAN/USAN)
  CYP3A4
   Haloperidol
    D01898  Haloperidol decanoate (JAN/USAN)
  CYP3A5
   Haloperidol
    D01898  Haloperidol decanoate (JAN/USAN)
  CYP3A7
   Haloperidol
    D01898  Haloperidol decanoate (JAN/USAN)
Psychiatric agents [br08363.html]
 Antipsychotics
  D01898
BRITE hierarchy
Other DBs
CAS: 
74050-97-8
PubChem: 
ChEBI: 
ChEMBL: 
DrugBank: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        37
            1   C1b C    16.3100  -17.5700
            2   C1b C    17.5000  -16.8700
            3   C1b C    18.6900  -17.5700
            4   N1y N    19.9500  -16.8700
            5   C1x C    19.9500  -15.4700
            6   C1x C    21.1400  -17.5700
            7   C1x C    21.1400  -14.7700
            8   C1x C    22.3300  -16.8700
            9   C1z C    22.3300  -15.4700
            10  C8y C    23.5900  -14.7700
            11  C8x C    23.5900  -13.4400
            12  C8x C    24.7800  -15.4700
            13  C8x C    24.7800  -12.7400
            14  C8x C    25.9700  -14.8400
            15  C8y C    25.9700  -13.4400
            16  X   Cl   27.1600  -12.7400
            17  C5a C    15.0500  -16.8700
            18  C8y C    13.7900  -17.5700
            19  O5a O    15.0500  -15.4000
            20  C8x C    13.7900  -18.9700
            21  C8x C    12.6000  -19.6700
            22  C8y C    11.3400  -18.9700
            23  C8x C    11.3400  -17.5700
            24  C8x C    12.6000  -16.8700
            25  X   F    10.0800  -19.6700
            26  O7a O    23.5200  -16.1700
            27  C7a C    23.5200  -17.5700
            28  C1b C    24.7100  -18.2700
            29  O6a O    22.2600  -18.2700
            30  C1b C    25.9000  -17.6400
            31  C1b C    27.0900  -18.2700
            32  C1b C    28.2800  -17.6400
            33  C1b C    29.4700  -18.2700
            34  C1b C    30.8000  -17.6400
            35  C1b C    31.9900  -18.2700
            36  C1b C    33.1800  -17.6400
            37  C1a C    34.3700  -18.2700
BOND        39
            1     1  17 1
            2     1   2 1
            3    17  18 1
            4     2   3 1
            5    17  19 2
            6     3   4 1
            7     4   5 1
            8     4   6 1
            9     5   7 1
            10    6   8 1
            11   18  20 1
            12   20  21 2
            13   21  22 1
            14   22  23 2
            15   23  24 1
            16   24  18 2
            17    7   9 1
            18   22  25 1
            19    9  10 1
            20   10  11 1
            21   10  12 2
            22   11  13 2
            23   12  14 1
            24   13  15 1
            25   15  16 1
            26    8   9 1
            27   14  15 2
            28    9  26 1
            29   26  27 1
            30   27  28 1
            31   27  29 2
            32   28  30 1
            33   30  31 1
            34   31  32 1
            35   32  33 1
            36   33  34 1
            37   34  35 1
            38   35  36 1
            39   36  37 1

» Japanese version   » Back

DBGET integrated database retrieval system