KEGG   DRUG: BisoprololHelp
Entry
D02342                      Drug                                   

Name
Bisoprolol (JAN/USAN/INN)
Formula
C18H31NO4
Exact mass
325.2253
Mol weight
325.443
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Class
Cardiovascular agent
 DG01653  Antiarrhythmics
  DG01806  Class II antiarrhythmic agent
 DG01466  Adrenergic receptor antagonist
  DG01464  beta-Adrenergic receptor antagonist
   DG01461  beta1-Adrenergic receptor antagonist
Remark
Same as: 
Therapeutic category: 
ATC code: 
Chemical group: 
Efficacy
Antihypertensive, beta1-Adrenergic receptor antagonist
Comment
Propranolol derivative
Target
ADRB1 [HSA:153] [KO:K04141]
  Pathway
Calcium signaling pathway
Neuroactive ligand-receptor interaction
Adrenergic signaling in cardiomyocytes
Salivary secretion
Interaction
Drug interaction
Structure map
beta-Adrenergic receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C07 BETA BLOCKING AGENTS
   C07A BETA BLOCKING AGENTS
    C07AB Beta blocking agents, selective
     C07AB07 Bisoprolol
      D02342  Bisoprolol (JAN/USAN/INN)
USP drug classification [BR:br08302]
 Cardiovascular Agents
  Beta-adrenergic Blocking Agents
   Bisoprolol
    D02342  Bisoprolol (JAN/USAN/INN)
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  21  Cardiovascular agents
   214  Antihypertensives
    2149  Others
     D02342  Bisoprolol (JAN/USAN/INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta1-adrenergic receptor
     Bisoprolol
      D02342  Bisoprolol (JAN/USAN/INN)
Cardiovascular agents [br08364.html]
 Antihypertensives
  D02342
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D02342
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D02342
BRITE hierarchy
Other DBs
CAS: 
66722-44-9
PubChem: 
ChEBI: 
ChEMBL: 
DrugBank: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        23
            1   C8y C    22.1200  -14.8400
            2   C8x C    23.3800  -15.5400
            3   C8x C    20.9300  -15.5400
            4   O2a O    22.1200  -13.4400
            5   C8x C    23.3800  -16.9400
            6   C8x C    20.9300  -16.9400
            7   C1b C    23.3100  -12.7400
            8   C8y C    22.1200  -17.6400
            9   C1c C    24.5700  -13.4400
            10  C1b C    22.1200  -19.0400
            11  C1b C    25.7600  -12.7400
            12  O1a O    24.5700  -14.8400
            13  O2a O    20.9300  -19.7400
            14  N1b N    26.9500  -13.4400
            15  C1b C    19.7400  -18.9700
            16  C1c C    28.2100  -12.7400
            17  C1b C    18.4800  -19.7400
            18  C1a C    29.4000  -13.4400
            19  C1a C    28.2100  -11.2700
            20  O2a O    17.2900  -18.9700
            21  C1c C    16.1000  -19.6700
            22  C1a C    14.8400  -18.9700
            23  C1a C    16.1000  -21.1400
BOND        23
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     4   7 1
            7     5   8 1
            8     7   9 1
            9     8  10 1
            10    9  11 1
            11    9  12 1
            12   10  13 1
            13   11  14 1
            14   13  15 1
            15   14  16 1
            16   15  17 1
            17   16  18 1
            18   16  19 1
            19   17  20 1
            20   20  21 1
            21   21  22 1
            22   21  23 1
            23    6   8 2

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