KEGG   DRUG: D05339Help
Entry
D05339                      Drug                                   

Name
Paliperidone (JAN/USAN/INN);
Invega (TN)
Product
Formula
C23H27FN4O3
Exact mass
426.2067
Mol weight
426.4839
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Treatment of schizophrenia
Remark
Therapeutic category: 
ATC code: 
Drug group: 
Comment
Serotonin-dopamine antagonists (SDA)
Target
5-HT2A-receptor antagonist [HSA:3356] [KO:K04157];
dopamine D2-receptor antagonist [HSA:1813] [KO:K04145]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04540  Gap junction  
 
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N05 PSYCHOLEPTICS
   N05A ANTIPSYCHOTICS
    N05AX Other antipsychotics
     N05AX13 Paliperidone
      D05339  Paliperidone (JAN/USAN/INN)
USP drug classification [BR:br08302]
 Antipsychotics
  2nd Generation/Atypical
   Paliperidone
    D05339  Paliperidone (JAN/USAN/INN)
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
     D05339  Paliperidone (JAN/USAN/INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Dopamine
    dopamine D2-receptor
     Paliperidone
      D05339  Paliperidone (JAN/USAN/INN)
   Serotonin
    5-HT2A-receptor
     Paliperidone
      D05339  Paliperidone (JAN/USAN/INN)
BRITE hierarchy
Other DBs
CAS: 
144598-75-4
PubChem: 
DrugBank: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        31
            1   C8y C    20.0200  -19.1800
            2   C8y C    20.0200  -17.7800
            3   N5x N    21.2100  -17.0800
            4   C8y C    22.4700  -17.7800
            5   N4y N    22.4700  -19.1800
            6   C8y C    21.2100  -19.8800
            7   C1y C    23.6600  -17.0800
            8   C1x C    24.8500  -17.7800
            9   C1x C    24.8500  -19.1800
            10  C1x C    23.6600  -19.8800
            11  O1a O    23.6600  -15.6800
            12  C1a C    18.8300  -17.0800
            13  O5x O    21.2100  -21.2800
            14  C1b C    18.8300  -19.8800
            15  C1b C    17.6400  -19.1800
            16  N1y N    16.4500  -19.8800
            17  C1x C    16.4500  -21.2800
            18  C1x C    15.2600  -21.9800
            19  C1y C    14.0700  -21.2800
            20  C1x C    14.0700  -19.8800
            21  C1x C    15.2600  -19.1800
            22  C8y C    12.8100  -21.9800
            23  N5x N    11.6753  -21.1600
            24  O2x O    10.5448  -21.9858
            25  C8y C    10.9808  -23.3162
            26  C8y C    12.3808  -23.3126
            27  C8x C    10.2839  -24.5304
            28  C8y C    10.9870  -25.7410
            29  C8x C    12.3870  -25.7375
            30  C8x C    13.0839  -24.5232
            31  X   F    10.2826  -26.9681
BOND        35
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    7  11 1
            13    2  12 1
            14    6  13 2
            15    1  14 1
            16   14  15 1
            17   15  16 1
            18   16  17 1
            19   17  18 1
            20   18  19 1
            21   19  20 1
            22   20  21 1
            23   16  21 1
            24   19  22 1
            25   22  23 2
            26   23  24 1
            27   24  25 1
            28   25  26 1
            29   22  26 1
            30   25  27 2
            31   27  28 1
            32   28  29 2
            33   29  30 1
            34   26  30 2
            35   28  31 1

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