KEGG   DRUG: D08443Help
Entry
D08443                      Drug                                   

Name
Propranolol (INN);
Propranolol (TN)
Formula
C16H21NO2
Exact mass
259.1572
Mol weight
259.3434
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
beta-Adrenergic blocking
Remark
Same as: 
ATC code: 
Drug group: 
Comment
Class II antiarrhythmic agent
Target
beta1-adrenergic receptor antagonist [HSA:153] [KO:K04141];
beta2-adrenergic receptor antagonist [HSA:154] [KO:K04142];
beta3-adrenergic receptor antagonist [HSA:155] [KO:K04143]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04261  Adrenergic signaling in cardiomyocytes
hsa04970  Salivary secretion  
 
Metabolism
Enzyme: CYP1A2 [HSA:1544], CYP2C19 [HSA:1557], CYP2D6 [HSA:1565], CYP3A4 [HSA:1576], CYP3A5 [HSA:1577], CYP3A7 [HSA:1551]
Interaction
Genomic biomarker: CYP2D6 [HSA:1565]
CYP inhibition: CYP1A2 [HSA:1544]
Drug interaction
Structure map
Antiarrhythmic drugs
Antimigraines
Naphthalene family
beta-Adrenergic receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C07 BETA BLOCKING AGENTS
   C07A BETA BLOCKING AGENTS
    C07AA Beta blocking agents, non-selective
     C07AA05 Propranolol
      D08443  Propranolol (INN)
USP drug classification [BR:br08302]
 Cardiovascular Agents
  Beta-adrenergic Blocking Agents
   Propranolol
    D08443  Propranolol (INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta1-adrenergic receptor
     Propranolol
      D08443  Propranolol (INN)
    beta2-adrenergic receptor
     Propranolol
      D08443  Propranolol (INN)
    beta3-adrenergic receptor
     Propranolol
      D08443  Propranolol (INN)
Cytochrome P450 interactions [BR:br08309]
 Substrates
  CYP1A2
   Propranolol
    D08443  Propranolol (INN)
  CYP2C19
   Propranolol
    D08443  Propranolol (INN)
  CYP2D6
   Propranolol
    D08443  Propranolol (INN)
  CYP3A4
   Propranolol
    D08443  Propranolol (INN)
   Propranolol
    D08443  Propranolol (INN)
  CYP3A5
   Propranolol
    D08443  Propranolol (INN)
  CYP3A7
   Propranolol
    D08443  Propranolol (INN)
 Inhbitors
  CYP1A2
   Propranolol
    D08443  Propranolol (INN)
BRITE hierarchy
Other DBs
CAS: 
525-66-6
PubChem: 
DrugBank: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        19
            1   C8y C    21.0700  -18.9700
            2   C8y C    22.3300  -18.2700
            3   C8y C    21.0700  -20.3700
            4   C8x C    19.8800  -18.2700
            5   O2a O    22.3300  -16.8700
            6   C8x C    23.5200  -18.9700
            7   C8x C    22.2600  -21.0700
            8   C8x C    19.8800  -21.0700
            9   C8x C    18.6900  -18.9700
            10  C1b C    23.5200  -16.1700
            11  C8x C    23.5200  -20.3700
            12  C8x C    18.6900  -20.3700
            13  C1c C    24.7100  -16.8700
            14  C1b C    25.9700  -16.1700
            15  O1a O    24.7100  -18.2700
            16  N1b N    27.1600  -16.8700
            17  C1c C    28.3500  -16.1700
            18  C1a C    29.6100  -16.8700
            19  C1a C    28.3500  -14.7700
BOND        20
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    6  11 1
            11    8  12 2
            12   10  13 1
            13   13  14 1
            14   13  15 1
            15   14  16 1
            16   16  17 1
            17   17  18 1
            18   17  19 1
            19    7  11 2
            20    9  12 1

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