KEGG   DRUG: D02034Help
Entry
D02034                      Drug                                   
Name
Setiptiline maleate (JAN);
Tecipul (TN)
Formula
C19H19N. C4H4O4
Exact mass
377.1627
Mol weight
377.433
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antidepressant
Remark
Therapeutic category: 
Comment
tetracyclic antidepressants
Target
alpha2-adrenergic receptor antagonist [HSA:150 151 152] [KO:K04138 K04139 K04140];
alpha1-adrenergic receptor antagonist [HSA:146 147 148] [KO:K04137 K04136 K04135];
5-HT2-receptor antagonist [HSA:3356 3357 3358] [KO:K04157]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04270  Vascular smooth muscle contraction
hsa04540  Gap junction
hsa04970  Salivary secretion  
 
Interaction
Drug interaction
Structure map
Antidepressants
Brite
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
     D02034  Setiptiline maleate (JAN)
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]
     Setiptiline
      D02034  Setiptiline maleate (JAN)
    alpha2-adrenergic receptor [HSA:150 151 152] [KO:K04138 K04139 K04140]
     Setiptiline
      D02034  Setiptiline maleate (JAN)
   Serotonin
    5-HT2-receptor [HSA:3356 3357 3358] [KO:K04157]
     Setiptiline
      D02034  Setiptiline maleate (JAN)
BRITE hierarchy
Other DBs
CAS: 
85650-57-3
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        28
            1   C2b C    36.5609  -16.2201
            2   C2b C    38.2962  -16.2201
            3   C6a C    35.8668  -17.4223
            4   O6a O    34.4786  -17.4232
            5   O6a O    36.5617  -18.6250
            6   C6a C    38.9903  -17.4223
            7   O6a O    40.3785  -17.4223
            8   O6a O    38.2958  -18.6253
            9   C2y C    27.9934  -17.6494
            10  C8y C    27.1513  -16.5398
            11  C8y C    27.4865  -15.1830
            12  C1x C    28.7475  -14.6049
            13  C2y C    29.3992  -17.6746
            14  C8y C    30.0011  -15.2272
            15  C8y C    30.2876  -16.5959
            16  C8x C    26.4794  -14.2146
            17  C8x C    25.1374  -14.6027
            18  C8x C    24.8022  -15.9595
            19  C8x C    25.8093  -16.9276
            20  C8x C    31.6188  -17.0330
            21  C8x C    32.6630  -16.0986
            22  C8x C    32.3766  -14.7299
            23  C8x C    31.0452  -14.2928
            24  C1x C    27.2717  -18.8490
            25  N1y N    27.9499  -20.0738
            26  C1x C    29.3557  -20.0991
            27  C1x C    30.0773  -18.8994
            28  C1a C    27.2159  -21.2942
BOND        30
            1     1   2 2
            2     1   3 1
            3     3   4 1
            4     3   5 2
            5     2   6 1
            6     6   7 2
            7     6   8 1
            8    11  12 1
            9     9  13 2
            10   12  14 1
            11   10  11 1
            12   13  15 1
            13    9  10 1
            14   14  15 1
            15   11  16 2
            16   16  17 1
            17   17  18 2
            18   18  19 1
            19   10  19 2
            20   15  20 2
            21   20  21 1
            22   21  22 2
            23   22  23 1
            24   14  23 2
            25    9  24 1
            26   24  25 1
            27   25  26 1
            28   26  27 1
            29   13  27 1
            30   25  28 1

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