KEGG   DRUG: D02995Help
Entry
D02995                      Drug                                   
Name
Asenapine maleate (USAN);
Saphris (TN)
Product
Formula
C17H16ClNO. C4H4O4
Exact mass
401.103
Mol weight
401.8402
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Treatment of psychosis [dopamine/serotonin antagonist with antagonism to D1, D2, D3, and D4 and 5-HT1A, 5-HT2A, 5-HT2C, 5-HT6, and 5-HT7 receptors as well as histamine H1 and alpha1 and alpha2 adrenergic receptors]
Remark
ATC code: 
Target
5-HT2-receptor antagonist [HSA:3356 3357 3358] [KO:K04157];
5-HT1-receptor antagonist [HSA:3350 3351 3352 3354 3355] [KO:K04153];
D2-receptor antagonist [HSA:1813] [KO:K04145];
alpha1-adrenergic receptor antagonist [HSA:146 147 148] [KO:K04137 K04136 K04135];
alpha2-adrenergic receptor antagonist [HSA:150 151 152] [KO:K04138 K04139 K04140]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04270  Vascular smooth muscle contraction
hsa04540  Gap junction
hsa04970  Salivary secretion  
 
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N05 PSYCHOLEPTICS
   N05A ANTIPSYCHOTICS
    N05AH Diazepines, oxazepines and thiazepines
     N05AH05 Asenapine
      D02995  Asenapine maleate (USAN)
USP drug classification [BR:br08302]
 Antipsychotics
  2nd Generation/Atypical
   Asenapine
    D02995  Asenapine maleate (USAN)
 Bipolar Agents
  Bipolar Agents, Other
   Asenapine
    D02995  Asenapine maleate (USAN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    alpha1-adrenergic receptor [HSA:146 147 148] [KO:K04137 K04136 K04135]
     Asenapine [ATC:N05AH05]
      D02995  Asenapine maleate (USAN)
    alpha2-adrenergic receptor [HSA:150 151 152] [KO:K04138 K04139 K04140]
     Asenapine [ATC:N05AH05]
      D02995  Asenapine maleate (USAN)
   Dopamine
    dopamine D2-receptor [HSA:1813] [KO:K04145]
     Asenapine [ATC:N05AH05]
      D02995  Asenapine maleate (USAN)
   Serotonin
    5-HT1-receptor [HSA:3350 3351 3352 3354 3355] [KO:K04153]
     Asenapine [ATC:N05AH05]
      D02995  Asenapine maleate (USAN)
    5-HT2-receptor [HSA:3356 3357 3358] [KO:K04157]
     Asenapine [ATC:N05AH05]
      D02995  Asenapine maleate (USAN)
BRITE hierarchy
Other DBs
CAS: 
85650-56-2
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        28
            1   C8y C    24.1718  -15.1922
            2   C1y C    25.0793  -16.2393
            3   C1y C    26.4755  -16.2393
            4   C8y C    27.3132  -15.1224
            5   C8y C    24.4511  -13.7960
            6   C8y C    26.9641  -13.7960
            7   O2x O    25.7076  -13.1678
            8   C8x C    28.0112  -12.8187
            9   C8x C    29.3376  -13.1678
            10  C8x C    29.6866  -14.5639
            11  C8x C    28.6395  -15.5412
            12  C8x C    22.8455  -15.6110
            13  C8y C    21.7984  -14.7035
            14  C8x C    22.0776  -13.3074
            15  C8x C    23.4040  -12.8885
            16  C1x C    26.9641  -17.5656
            17  N1y N    25.8472  -18.4033
            18  C1x C    24.6605  -17.5656
            19  X   Cl   20.4720  -15.1224
            20  C1a C    25.8472  -19.7995
            21  O6a O    31.5016  -16.3789
            22  C6a C    32.8279  -16.3789
            23  O6a O    33.5260  -17.4958
            24  C2b C    33.5260  -15.1922
            25  C2b C    35.1316  -15.1922
            26  C6a C    35.8297  -16.3789
            27  O6a O    37.2258  -16.3789
            28  O6a O    35.2014  -17.5656
BOND        30
            1     3   4 1
            2     1   5 1
            3     4   6 1
            4     2   3 1
            5     5   7 1
            6     1   2 1
            7     6   7 1
            8     6   8 2
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12    4  11 2
            13    1  12 2
            14   12  13 1
            15   13  14 2
            16   14  15 1
            17    5  15 2
            18    3  16 1
            19   16  17 1
            20   17  18 1
            21    2  18 1
            22   13  19 1
            23   17  20 1
            24   21  22 1
            25   22  23 2
            26   22  24 1
            27   24  25 2
            28   25  26 1
            29   26  27 2
            30   26  28 1

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