KEGG   DRUG: Bromodiphenhydramine hydrochloride
Entry
D03166                      Drug                                   
Name
Bromodiphenhydramine hydrochloride (USP);
Bromazine hydrochloride;
Bromanyl (TN)
Formula
C17H21BrNO. Cl
Exact mass
369.0495
Mol weight
370.7117
Structure
Simcomp
Class
Anti-allergic agent
 DG01557  Histamine receptor antagonist
  DG01482  Histamine receptor H1 antagonist
Remark
ATC code: R06AA01
Efficacy
Antiallergic, H1 receptor antagonist
Comment
Bromodiphenhydramine is called Bromazine in INN.
Target
HRH1 [HSA:3269] [KO:K04149]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04750  Inflammatory mediator regulation of TRP channels
Interaction
Structure map
map07212  Histamine H1 receptor antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 R RESPIRATORY SYSTEM
  R06 ANTIHISTAMINES FOR SYSTEMIC USE
   R06A ANTIHISTAMINES FOR SYSTEMIC USE
    R06AA Aminoalkyl ethers
     R06AA01 Bromazine
      D03166  Bromodiphenhydramine hydrochloride (USP)
Drug groups [BR:br08330]
 Anti-allergic agent
  DG01557  Histamine receptor antagonist
   DG01482  Histamine receptor H1 antagonist
    D03166  Bromodiphenhydramine hydrochloride
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Histamine
    HRH1
     D03166  Bromodiphenhydramine hydrochloride (USP)
Other DBs
CAS: 1808-12-4
PubChem: 17397320
ChEBI: 59178
LigandBox: D03166
NIKKAJI: J535.360B
LinkDB
KCF data

ATOM        21
            1   C8x C    18.9000  -33.7400
            2   C8y C    18.9000  -35.1400
            3   C8x C    20.1124  -35.8400
            4   C8x C    21.3249  -35.1400
            5   C8y C    21.3249  -33.7400
            6   C8x C    20.1124  -33.0400
            7   C1c C    22.5560  -33.0290
            8   C8y C    23.7612  -33.7247
            9   C8x C    23.7616  -35.1396
            10  C8x C    24.9742  -35.8393
            11  C8x C    26.1865  -35.1389
            12  C8x C    26.1860  -33.7239
            13  C8x C    24.9734  -33.0243
            14  O2a O    22.5557  -31.6401
            15  X   Br   17.6876  -35.8400
            16  C1b C    23.7562  -30.9466
            17  C1b C    24.9462  -31.6335
            18  N1c N    26.1360  -30.9462 #+
            19  C1a C    27.3263  -31.6332
            20  C1a C    26.1359  -29.5402
            21  X   Cl   29.7500  -34.5800 #-
BOND        21
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     5   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11   10  11 2
            12   11  12 1
            13   12  13 2
            14    8  13 1
            15    7  14 1
            16    2  15 1
            17   14  16 1
            18   16  17 1
            19   17  18 1
            20   18  19 1
            21   18  20 1

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