KEGG   DRUG: D00603Help
Entry
D00603                      Drug                                   

Name
Timolol maleate (JP16/USP);
Blocadren (TN);
Istalol (TN);
Timoptic (TN)
Product
  Generic
Formula
C13H24N4O3S. C4H4O4
Exact mass
432.1679
Mol weight
432.4918
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Anti-adrenergic [beta-receptor] [DS:H00612]
Remark
Therapeutic category: 
ATC code: 
Drug group: 
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
hsa04144  Endocytosis
hsa04261  Adrenergic signaling in cardiomyocytes
hsa04540  Gap junction
hsa04970  Salivary secretion  
 
Metabolism
Enzyme: CYP2D6 [HSA:1565]
Interaction
Genomic biomarker: CYP2D6 [HSA:1565]
Drug interaction
Structure map
Antiglaucoma agents
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
     C07AA06 Timolol
      D00603  Timolol maleate (JP16/USP)
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01E ANTIGLAUCOMA PREPARATIONS AND MIOTICS
    S01ED Beta blocking agents
     S01ED01 Timolol
      D00603  Timolol maleate (JP16/USP)
USP drug classification [BR:br08302]
 Antimigraine Agents
  Prophylactic
   Timolol
    D00603  Timolol maleate (JP16/USP)
 Cardiovascular Agents
  Beta-adrenergic Blocking Agents
   Timolol
    D00603  Timolol maleate (JP16/USP)
 Ophthalmic Agents
  Ophthalmic Antiglaucoma Agents
   Timolol
    D00603  Timolol maleate (JP16/USP)
Therapeutic category of drugs in Japan [BR:br08301]
 1  Agents affecting nervous system and sensory organs
  13  Agents affecting sensory organs
   131  Ophthalmic agents
    1319  Others
     D00603  Timolol maleate (JP16/USP)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta1-adrenergic receptor
     Timolol
      D00603  Timolol maleate (JP16/USP)
    beta2-adrenergic receptor
     Timolol
      D00603  Timolol maleate (JP16/USP)
    beta3-adrenergic receptor
     Timolol
      D00603  Timolol maleate (JP16/USP)
Cytochrome P450 interactions [BR:br08309]
 Substrates
  CYP2D6
   Timolol
    D00603  Timolol maleate (JP16/USP)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00603  Timolol maleate
BRITE hierarchy
Other DBs
CAS: 
26921-17-5
PubChem: 
DrugBank: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        29
            1   C2b C    27.1995  -15.4829
            2   C2b C    25.5020  -15.4829
            3   C6a C    27.8361  -16.6145
            4   C6a C    24.8653  -16.6852
            5   O6a O    27.1995  -17.8170
            6   O6a O    29.2508  -16.6145
            7   O6a O    23.4508  -16.6852
            8   O6a O    25.5020  -17.8170
            9   C1b C    14.1400  -15.9600
            10  C1c C    15.3300  -16.6600
            11  O2a O    12.9500  -16.6600
            12  C1b C    16.5200  -15.9600
            13  N1b N    17.7100  -16.6600
            14  C1d C    18.9000  -15.9600
            15  C1a C    20.1600  -16.6600
            16  C1a C    18.9000  -14.5600
            17  C1a C    20.1600  -15.2600
            18  O1a O    15.3300  -18.0600
            19  C8y C    12.9500  -18.0600
            20  C8y C    11.8300  -18.9700
            21  N5x N    12.2500  -20.2300
            22  S2x S    13.6500  -20.2300
            23  N5x N    14.0700  -18.9700
            24  O2x O     8.1200  -16.8000
            25  C1x C     8.1200  -18.2700
            26  C1x C     9.3100  -18.9700
            27  N1y N    10.5700  -18.2700
            28  C1x C    10.5700  -16.8000
            29  C1x C     9.3100  -16.1000
BOND        29
            1     1   2 2
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     3   6 2
            6     4   7 1
            7     4   8 2
            8     9  10 1
            9     9  11 1
            10   10  12 1
            11   12  13 1
            12   13  14 1
            13   14  15 1
            14   14  16 1
            15   14  17 1
            16   10  18 1 #Down
            17   11  19 1
            18   19  20 1
            19   20  21 2
            20   21  22 1
            21   22  23 1
            22   19  23 2
            23   24  25 1
            24   25  26 1
            25   26  27 1
            26   27  28 1
            27   28  29 1
            28   24  29 1
            29   27  20 1

» Japanese version   » Back

DBGET integrated database retrieval system