KEGG   DRUG: D02363Help
Entry
D02363                      Drug                                   

Name
Ketanserin (USAN/INN)
Formula
C22H22FN3O3
Exact mass
395.1645
Mol weight
395.4268
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Serotonin antagonist, Antihypertensive
Remark
Same as: 
ATC code: 
Drug group: 
Target
5-HT2A-receptor antagonist [HSA:3356] [KO:K04157];
alpha1-adrenergic receptor antagonist [HSA:146 147 148] [KO:K04137 K04136 K04135];
H1-receptor antagonist [HSA:3269] [KO:K04149]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04270  Vascular smooth muscle contraction
hsa04726  Serotonergic synapse  
 
Interaction
Drug interaction
Structure map
Serotonin receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C02 ANTIHYPERTENSIVES
   C02K OTHER ANTIHYPERTENSIVES
    C02KD Serotonin antagonists
     C02KD01 Ketanserin
      D02363  Ketanserin (USAN/INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    alpha1-adrenergic receptor
     Ketanserin
      D02363  Ketanserin (USAN/INN)
   Histamine
    H1-receptor
     Ketanserin
      D02363  Ketanserin (USAN/INN)
   Serotonin
    5-HT2A-receptor
     Ketanserin
      D02363  Ketanserin (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 
74050-98-9
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        29
            1   C8y C    36.3464  -12.6205
            2   C8y C    36.3464  -14.0201
            3   N4x N    35.1335  -11.9208
            4   C8x C    37.5594  -11.9208
            5   C8y C    35.1335  -14.7198
            6   C8x C    37.5594  -14.7198
            7   C8y C    33.9206  -12.6205
            8   C8x C    38.7723  -12.6205
            9   N4y N    33.9206  -14.0201
            10  O5x O    35.1335  -16.1194
            11  C8x C    38.7723  -14.0201
            12  O5x O    32.7076  -11.9208
            13  C1b C    32.7076  -14.7198
            14  C1b C    31.4947  -14.0201
            15  N1y N    30.2818  -14.7198
            16  C1x C    29.0688  -14.0201
            17  C1x C    30.2818  -16.1194
            18  C1x C    27.8559  -14.7198
            19  C1x C    29.0688  -16.8191
            20  C1y C    27.8559  -16.1194
            21  C5a C    26.6440  -16.8193
            22  O5a O    26.6442  -18.2187
            23  C8y C    25.4430  -16.1258
            24  C8x C    25.4437  -14.7004
            25  C8x C    24.2316  -13.9998
            26  C8y C    23.0189  -14.6992
            27  C8x C    23.0181  -16.1246
            28  C8x C    24.2302  -16.8252
            29  X   F    21.8155  -14.0036
BOND        32
            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     4   8 1
            8     5   9 1
            9     5  10 2
            10    6  11 1
            11    7  12 2
            12    9  13 1
            13   13  14 1
            14   14  15 1
            15   15  16 1
            16   15  17 1
            17   16  18 1
            18   17  19 1
            19   18  20 1
            20    7   9 1
            21    8  11 2
            22   19  20 1
            23   20  21 1
            24   21  22 2
            25   21  23 1
            26   23  24 2
            27   24  25 1
            28   25  26 2
            29   26  27 1
            30   27  28 2
            31   23  28 1
            32   26  29 1

» Japanese version   » Back

DBGET integrated database retrieval system