KEGG   DRUG: Pirenzepine hydrochloride hydrate
Entry
D05276                      Drug                                   

Name
Pirenzepine hydrochloride hydrate (JP17);
Gastrozepin (TN)
Formula
C19H21N5O2. 2HCl. H2O
Exact mass
441.1334
Mol weight
442.3395
Structure
Simcomp
Class
Neuropsychiatric agent
 DG01491  Muscarinic cholinergic receptor antagonist
Gastrointestinal agent
 DG01975  Agents for peptic ulcer
Remark
Therapeutic category: 2329
ATC code: A02BX03
Chemical structure group: DG00026
Product (DG00026): D05276<JP>
Efficacy
Antisecretory (gastric acid), Anti-ulcerative, Muscarinic acetylcholine receptor antagonist
Comment
Tricyclic compound
Target
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04725  Cholinergic synapse
hsa04971  Gastric acid secretion
hsa04972  Pancreatic secretion
Interaction
Structure map
map07038  Antiulcer drugs
map07220  Cholinergic and anticholinergic drugs
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A02 DRUGS FOR ACID RELATED DISORDERS
   A02B DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
    A02BX Other drugs for peptic ulcer and gastro-oesophageal reflux disease (GORD)
     A02BX03 Pirenzepine
      D05276  Pirenzepine hydrochloride hydrate (JP17) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  23  Digestive organ agents
   232  Peptic ulcer agents
    2329  Others
     D05276  Pirenzepine hydrochloride hydrate (JP17)
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Inorganic and organic chemicals
   Pirenzepine
    D05276  Pirenzepine hydrochloride hydrate (JP17)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    CHRM
     D05276  Pirenzepine hydrochloride hydrate (JP17) <JP>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D05276  Pirenzepine hydrochloride hydrate
Rx-to-OTC switch list in Japan [br08314.html]
 D05276
Other DBs
PubChem: 17398264
DrugBank: DB00670
LigandBox: D05276
LinkDB
KCF data

ATOM        29
            1   O0  O    36.9166  -21.1757
            2   X   Cl   36.5234  -18.9862
            3   C5x C    29.1159  -24.0767
            4   C8y C    28.2760  -22.9569
            5   C8y C    28.6260  -21.6271
            6   N1y N    29.8858  -21.0672
            7   N1x N    30.5157  -24.0767
            8   C8y C    31.1456  -21.6971
            9   C8y C    31.4256  -23.0269
            10  C8x C    27.5761  -20.6472
            11  C8x C    26.2463  -21.0672
            12  C8x C    25.8964  -22.3970
            13  C8x C    26.9462  -23.3768
            14  C8x C    32.7554  -23.4468
            15  C8x C    33.8053  -22.5370
            16  C8x C    33.5253  -21.1372
            17  N5x N    32.1955  -20.7172
            18  O5x O    28.4860  -25.3366
            19  C5a C    29.8858  -19.6674
            20  C1b C    31.0757  -18.9675
            21  O5a O    28.6960  -18.9675
            22  N1y N    31.0757  -17.5677
            23  C1x C    32.3355  -16.8678
            24  C1x C    32.3355  -15.4680
            25  N1y N    31.0757  -14.7680
            26  C1x C    29.8858  -15.4680
            27  C1x C    29.8858  -16.8678
            28  C1a C    31.0757  -13.3682
            29  X   Cl   36.5234  -18.9862
BOND        29
            1     5   6 1
            2     3   7 1
            3     6   8 1
            4     4   5 1
            5     7   9 1
            6     3   4 1
            7     8   9 1
            8     5  10 2
            9    10  11 1
            10   11  12 2
            11   12  13 1
            12    4  13 2
            13    9  14 2
            14   14  15 1
            15   15  16 2
            16   16  17 1
            17    8  17 2
            18    3  18 2
            19    6  19 1
            20   19  20 1
            21   19  21 2
            22   20  22 1
            23   22  23 1
            24   23  24 1
            25   24  25 1
            26   25  26 1
            27   26  27 1
            28   22  27 1
            29   25  28 1
BRACKET     1    34.7900  -19.9500   34.7900  -17.7800
            1    37.3100  -17.7800   37.3100  -19.9500
            1  2
 ORIGINAL  1    2
 REPEAT    1   29

» Japanese version   » Back

KEGG   DRUG: Pirenzepine
Entry
D08389                      Drug                                   

Name
Pirenzepine (INN)
Formula
C19H21N5O2
Exact mass
351.1695
Mol weight
351.4023
Structure
Simcomp
Class
Neuropsychiatric agent
 DG01491  Muscarinic cholinergic receptor antagonist
Gastrointestinal agent
 DG01975  Agents for peptic ulcer
Remark
Same as: C07508
ATC code: A02BX03
Chemical structure group: DG00026
Product (DG00026): D05276<JP>
Efficacy
Antisecretory (gastric acid), Anti-ulcerative, Muscarinic acetylcholine receptor antagonist
Comment
Tricyclic compound
Target
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04725  Cholinergic synapse
hsa04971  Gastric acid secretion
hsa04972  Pancreatic secretion
Interaction
Structure map
map07038  Antiulcer drugs
map07220  Cholinergic and anticholinergic drugs
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A02 DRUGS FOR ACID RELATED DISORDERS
   A02B DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
    A02BX Other drugs for peptic ulcer and gastro-oesophageal reflux disease (GORD)
     A02BX03 Pirenzepine
      D08389  Pirenzepine (INN)
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Inorganic and organic chemicals
   Pirenzepine
    D08389  Pirenzepine (INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    CHRM
     D08389  Pirenzepine (INN)
Other DBs
CAS: 28797-61-7
PubChem: 96025075
ChEBI: 8247
ChEMBL: CHEMBL9967
DrugBank: DB00670
LigandBox: D08389
NIKKAJI: J20.030A
LinkDB
KCF data

ATOM        26
            1   C5x C    23.3800  -22.6800
            2   C8y C    22.5400  -21.6300
            3   C8y C    22.8900  -20.2300
            4   N1y N    24.1500  -19.6700
            5   N1x N    24.7800  -22.7500
            6   C8y C    25.4100  -20.3000
            7   C8y C    25.6900  -21.6300
            8   C8x C    21.9100  -19.2500
            9   C8x C    20.5100  -19.6700
            10  C8x C    20.2300  -21.0000
            11  C8x C    21.2100  -21.9800
            12  C8x C    27.0200  -22.1200
            13  C8x C    28.0700  -21.1400
            14  C8x C    27.7900  -19.8100
            15  N5x N    26.4600  -19.3200
            16  O5x O    22.7500  -23.9400
            17  C5a C    24.1500  -18.2700
            18  C1b C    25.4100  -17.5700
            19  O5a O    22.9600  -17.5700
            20  N1y N    25.4100  -16.1700
            21  C1x C    26.6000  -15.5400
            22  C1x C    26.6000  -14.1400
            23  N1y N    25.4100  -13.4400
            24  C1x C    24.2200  -14.0700
            25  C1x C    24.2200  -15.4700
            26  C1a C    25.4100  -11.9700
BOND        29
            1     3   4 1
            2     1   5 1
            3     4   6 1
            4     2   3 1
            5     5   7 1
            6     1   2 1
            7     6   7 1
            8     3   8 2
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12    2  11 2
            13    7  12 2
            14   12  13 1
            15   13  14 2
            16   14  15 1
            17    6  15 2
            18    1  16 2
            19    4  17 1
            20   17  18 1
            21   17  19 2
            22   18  20 1
            23   20  21 1
            24   21  22 1
            25   22  23 1
            26   23  24 1
            27   24  25 1
            28   20  25 1
            29   23  26 1

» Japanese version   » Back

KEGG   DRUG: Pirenzepine hydrochloride
Entry
D01297                      Drug                                   

Name
Pirenzepine hydrochloride (USAN)
Formula
C19H21N5O2. 2HCl
Exact mass
423.1229
Mol weight
424.3242
Structure
Simcomp
Class
Neuropsychiatric agent
 DG01491  Muscarinic cholinergic receptor antagonist
Gastrointestinal agent
 DG01975  Agents for peptic ulcer
Remark
ATC code: A02BX03
Chemical structure group: DG00026
Product (DG00026): D05276<JP>
Efficacy
Antisecretory (gastric acid), Anti-ulcerative, Muscarinic acetylcholine receptor antagonist
Comment
Tricyclic compound
Target
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04725  Cholinergic synapse
hsa04971  Gastric acid secretion
hsa04972  Pancreatic secretion
Interaction
Structure map
map07038  Antiulcer drugs
map07220  Cholinergic and anticholinergic drugs
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A02 DRUGS FOR ACID RELATED DISORDERS
   A02B DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
    A02BX Other drugs for peptic ulcer and gastro-oesophageal reflux disease (GORD)
     A02BX03 Pirenzepine
      D01297  Pirenzepine hydrochloride (USAN)
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Inorganic and organic chemicals
   Pirenzepine
    D01297  Pirenzepine hydrochloride (USAN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    CHRM
     D01297  Pirenzepine hydrochloride (USAN)
Other DBs
CAS: 29868-97-1
PubChem: 7848360
ChEBI: 32014
ChEMBL: CHEMBL1531864
DrugBank: DB00670
LigandBox: D01297
NIKKAJI: J259.362I
LinkDB
KCF data

ATOM        28
            1   X   Cl   36.4585  -18.1487
            2   C5x C    29.0500  -23.2400
            3   C8y C    28.2100  -22.1200
            4   C8y C    28.5600  -20.7900
            5   N1y N    29.8200  -20.2300
            6   N1x N    30.4500  -23.2400
            7   C8y C    31.0800  -20.8600
            8   C8y C    31.3600  -22.1900
            9   C8x C    27.5100  -19.8100
            10  C8x C    26.1800  -20.2300
            11  C8x C    25.8300  -21.5600
            12  C8x C    26.8800  -22.5400
            13  C8x C    32.6900  -22.6100
            14  C8x C    33.7400  -21.7000
            15  C8x C    33.4600  -20.3000
            16  N5x N    32.1300  -19.8800
            17  O5x O    28.4200  -24.5000
            18  C5a C    29.8200  -18.8300
            19  C1b C    31.0100  -18.1300
            20  O5a O    28.6300  -18.1300
            21  N1y N    31.0100  -16.7300
            22  C1x C    32.2700  -16.0300
            23  C1x C    32.2700  -14.6300
            24  N1y N    31.0100  -13.9300
            25  C1x C    29.8200  -14.6300
            26  C1x C    29.8200  -16.0300
            27  C1a C    31.0100  -12.5300
            28  X   Cl   36.4585  -18.1487
BOND        29
            1     4   5 1
            2     2   6 1
            3     5   7 1
            4     3   4 1
            5     6   8 1
            6     2   3 1
            7     7   8 1
            8     4   9 2
            9     9  10 1
            10   10  11 2
            11   11  12 1
            12    3  12 2
            13    8  13 2
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17    7  16 2
            18    2  17 2
            19    5  18 1
            20   18  19 1
            21   18  20 2
            22   19  21 1
            23   21  22 1
            24   22  23 1
            25   23  24 1
            26   24  25 1
            27   25  26 1
            28   21  26 1
            29   24  27 1
BRACKET     1    34.7900  -19.1800   34.7900  -17.0100
            1    37.3100  -17.0100   37.3100  -19.1800
            1  2
 ORIGINAL  1    1
 REPEAT    1   28

» Japanese version   » Back

DBGET integrated database retrieval system