KEGG   DRUG: Pranlukast
Entry
D08408                      Drug                                   
Name
Pranlukast (INN);
Azlaire (TN)
Formula
C27H23N5O4
Exact mass
481.175
Mol weight
481.5026
Structure
Class
Anti-allergic agent
 DG01541  Cysteinyl leukotriene receptor antagonist
Metabolizing enzyme substrate
 DG01633  CYP3A/CYP3A4 substrate
  DG02913  CYP3A4 substrate
Remark
ATC code: R03DC02
Chemical structure group: DG01065
Product (DG01065): D02732<JP>
Efficacy
Antiallergic, Antiasthmatic, Anti-inflammatory, Leukotriene receptor antagonist
Target
CYSLTR1 [HSA:10800] [KO:K04322]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
Metabolism
Enzyme: CYP3A4 [HSA:1576]
Interaction
Structure map
map07034  Eicosanoids
map07228  Eicosanoid receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 R RESPIRATORY SYSTEM
  R03 DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
   R03D OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
    R03DC Leukotriene receptor antagonists
     R03DC02 Pranlukast
      D08408  Pranlukast (INN)
Drug groups [BR:br08330]
 Anti-allergic agent
  DG01541  Cysteinyl leukotriene receptor antagonist
   DG01065  Pranlukast
    D08408  Pranlukast
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG02913  CYP3A4 substrate
    DG01065  Pranlukast
     D08408  Pranlukast
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Cysteinyl leukotriene
    CYSLTR1
     D08408  Pranlukast (INN)
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D08408
Drug groups [BR:br08330]
 Anti-allergic agent
  DG01541  Cysteinyl leukotriene receptor antagonist
   DG01065  Pranlukast
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG02913  CYP3A4 substrate
    DG01065  Pranlukast
Other DBs
CAS: 103177-37-3
PubChem: 96025094
PDB-CCD: KNT[PDBj]
LigandBox: D08408
NIKKAJI: J326.578A
LinkDB
KCF data

ATOM        36
            1   C8y C    22.3300  -19.3200
            2   C8x C    23.5200  -20.0900
            3   C8x C    24.7800  -19.3200
            4   C8y C    24.7800  -17.9200
            5   C8x C    23.5200  -17.2200
            6   C8x C    22.3300  -17.9200
            7   C5a C    21.1400  -20.0900
            8   N1b N    19.8800  -19.3900
            9   O5a O    21.1400  -21.4900
            10  C8y C    18.6900  -20.0200
            11  C8y C    17.5000  -19.3900
            12  C8y C    16.3100  -20.0900
            13  C8x C    16.3100  -21.4900
            14  C8x C    17.5000  -22.1900
            15  C8x C    18.6900  -21.4200
            16  O2a O    25.9700  -17.2200
            17  C1b C    27.2300  -17.9200
            18  C1b C    28.4200  -17.2200
            19  C1b C    29.6100  -17.9200
            20  C1b C    30.8700  -17.2200
            21  C8y C    32.0600  -17.9200
            22  C8x C    32.0600  -19.3200
            23  C8x C    33.3200  -20.0900
            24  C8x C    34.5100  -19.3200
            25  C8x C    34.5100  -17.9200
            26  C8x C    33.3200  -17.2200
            27  O2x O    17.5000  -17.9900
            28  C8y C    16.3100  -17.2200
            29  C8x C    15.1200  -17.9900
            30  C8y C    15.1200  -19.3900
            31  C8y C    16.3100  -15.8200
            32  N4x N    17.4300  -15.0500
            33  N5x N    17.0100  -13.7200
            34  N5x N    15.6100  -13.7200
            35  N5x N    15.1900  -15.0500
            36  O5x O    13.8600  -20.0900
BOND        40
            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     1   7 1
            8     7   8 1
            9     7   9 2
            10    8  10 1
            11   10  11 2
            12   11  12 1
            13   12  13 2
            14   13  14 1
            15   14  15 2
            16   10  15 1
            17    4  16 1
            18   16  17 1
            19   17  18 1
            20   18  19 1
            21   19  20 1
            22   20  21 1
            23   21  22 2
            24   22  23 1
            25   23  24 2
            26   24  25 1
            27   25  26 2
            28   21  26 1
            29   11  27 1
            30   27  28 1
            31   28  29 2
            32   29  30 1
            33   12  30 1
            34   28  31 1
            35   31  32 1
            36   32  33 1
            37   33  34 2
            38   34  35 1
            39   31  35 2
            40   30  36 2

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