KEGG   DRUG: Loratadine
Entry
D00364                      Drug                                   
Name
Loratadine (JAN/USP/INN);
Claritin (TN)
Formula
C22H23ClN2O2
Exact mass
382.1448
Mol weight
382.8832
Structure
Simcomp
Class
Anti-allergic agent
 DG01557  Histamine receptor antagonist
  DG01482  Histamine receptor H1 antagonist
Dermatological agent
 DG03243  Atopic dermatitis agent
Metabolizing enzyme substrate
 DG01644  CYP2D6 substrate
 DG01633  CYP3A/CYP3A4 substrate
  DG02913  CYP3A4 substrate
Remark
Therapeutic category: 4490
ATC code: R06AX13
Product: D00364<JP>
Efficacy
Antiallergic, H1 receptor antagonist
Target
HRH1 [HSA:3269] [KO:K04149]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04750  Inflammatory mediator regulation of TRP channels
Metabolism
Enzyme: CYP2D6 [HSA:1565], CYP3A4 [HSA:1576]
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
    R06AX Other antihistamines for systemic use
     R06AX13 Loratadine
      D00364  Loratadine (JAN/USP/INN) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
 4  Agents affecting cellular function
  44  Allergic agents
   449  Miscellaneous
    4490  Miscellaneous
     D00364  Loratadine (JAN/USP/INN)
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Inorganic and organic chemicals
   Loratadine
    D00364  Loratadine (JAN/USP/INN)
Drug groups [BR:br08330]
 Anti-allergic agent
  DG01557  Histamine receptor antagonist
   DG01482  Histamine receptor H1 antagonist
    D00364  Loratadine
 Dermatological agent
  DG03243  Atopic dermatitis agent
   D00364  Loratadine
 Metabolizing enzyme substrate
  DG01644  CYP2D6 substrate
   D00364  Loratadine
  DG01633  CYP3A/CYP3A4 substrate
   DG02913  CYP3A4 substrate
    D00364  Loratadine
Drug classes [BR:br08332]
 Anti-allergic agent
  DG01482  Histamine receptor H1 antagonist
   D00364  Loratadine
 Dermatological agent
  DG03243  Atopic dermatitis agent
   D00364  Loratadine
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Histamine
    HRH1
     D00364  Loratadine (JAN/USP/INN) <JP>
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D00364
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D00364
Rx-to-OTC switch list in the USA [br08315.html]
 D00364
Rx-to-OTC switch list in Japan [br08314.html]
 D00364
Other DBs
CAS: 79794-75-5
PubChem: 7847430
ChEBI: 6538
LigandBox: D00364
NIKKAJI: J23.749C
KCF data

ATOM        27
            1   C1x C    14.9552  -13.2773
            2   C8y C    14.1108  -12.1647
            3   C8y C    14.4469  -10.8042
            4   C2y C    15.7114  -10.2245
            5   C1x C    16.3648  -13.3026
            6   C8y C    16.9683  -10.8485
            7   C8y C    17.2556  -12.2210
            8   C8x C    13.4370   -9.8331
            9   C8x C    12.0914  -10.2223
            10  C8y C    11.7553  -11.5828
            11  C8x C    12.7651  -12.5536
            12  C8x C    18.5904  -12.6593
            13  C8x C    19.6375  -11.7223
            14  C8x C    19.3504  -10.3498
            15  N5x N    18.0153   -9.9115
            16  C2y C    15.6631   -8.8458
            17  X   Cl   10.4237  -11.9675
            18  C1x C    16.8756   -8.1458
            19  C1x C    16.8756   -6.7458
            20  N1y N    15.6631   -6.0458
            21  C1x C    14.4507   -6.7458
            22  C1x C    14.4507   -8.1458
            23  C7a C    15.6628   -4.6201
            24  O6a O    14.4631   -3.9277
            25  O7a O    16.8880   -3.9123
            26  C1b C    18.0903   -4.6062
            27  C1a C    19.2739   -3.9225
BOND        30
            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    4  16 2
            19   10  17 1
            20   16  18 1
            21   18  19 1
            22   19  20 1
            23   20  21 1
            24   21  22 1
            25   16  22 1
            26   20  23 1
            27   23  24 2
            28   23  25 1
            29   25  26 1
            30   26  27 1

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