KEGG   DRUG: Mefloquine
Entry
D04895                      Drug                                   
Name
Mefloquine (USAN/INN)
Formula
C17H16F6N2O
Exact mass
378.1167
Mol weight
378.31
Structure
Simcomp
Class
Metabolizing enzyme substrate
 DG01633  CYP3A/CYP3A4 substrate
Remark
Same as: C07633
ATC code: P01BC02
Chemical structure group: DG01020
Product (DG01020): D00831<JP/US>
Efficacy
Antimalarial
Comment
Methanolquinoline
Metabolism
Enzyme: CYP3A [HSA:1576 1577 1551]
Interaction
Structure map
map07025  Quinolines
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 P ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
  P01 ANTIPROTOZOALS
   P01B ANTIMALARIALS
    P01BC Methanolquinolines
     P01BC02 Mefloquine
      D04895  Mefloquine (USAN/INN)
Drug groups [BR:br08330]
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG01020  Mefloquine
    D04895  Mefloquine
Antimicrobials [BR:br08307]
 Antiparasitics
  Antmalarials
   Methanolquinoline
    D04895  Mefloquine (USAN/INN)
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D04895
Drug groups [BR:br08330]
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG01020  Mefloquine
Other DBs
CAS: 53230-10-7
PubChem: 47206659
ChEBI: 63609 63681
LigandBox: D04895
NIKKAJI: J244.888B
LinkDB
KCF data

ATOM        26
            1   C8y C    17.5956  -17.6229
            2   C8y C    17.5490  -16.2269
            3   C8y C    16.2989  -18.3064
            4   N5x N    18.7231  -18.3413
            5   C8y C    18.7641  -15.5492
            6   C8x C    16.3457  -15.5024
            7   C8x C    15.0956  -17.5879
            8   C1d C    16.2873  -19.7025
            9   C8y C    19.9440  -17.6580
            10  C8x C    19.9616  -16.2619
            11  C1c C    18.7465  -14.1472
            12  C8x C    15.1130  -16.1801
            13  X   F    14.8853  -19.6966
            14  X   F    17.6833  -19.7025
            15  X   F    16.2756  -21.1045
            16  C1d C    21.1416  -18.3706
            17  C1y C    19.9616  -13.4462
            18  O1a O    17.5315  -13.4519
            19  X   F    22.3450  -19.0717
            20  X   F    21.8308  -17.1555
            21  X   F    20.4348  -19.5798
            22  C1x C    21.1767  -14.1472
            23  N1x N    19.9616  -12.0442
            24  C1x C    22.3916  -13.4402
            25  C1x C    21.1767  -11.3432
            26  C1x C    22.3916  -12.0384
BOND        28
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 2
            9     5  10 2
            10    5  11 1
            11    6  12 2
            12    8  13 1
            13    8  14 1
            14    8  15 1
            15    9  16 1
            16   11  17 1
            17   11  18 1 #Down
            18   16  19 1
            19   16  20 1
            20   16  21 1
            21   17  22 1
            22   17  23 1
            23   22  24 1
            24   23  25 1
            25   24  26 1
            26    7  12 1
            27    9  10 1
            28   25  26 1

» Japanese version   » Back

KEGG   DRUG: Mefloquine hydrochloride
Entry
D00831                      Drug                                   
Name
Mefloquine hydrochloride (JP18/USP);
Lariam (TN)
Product
  Generic
MEFLOQUINE HYDROCHLORIDE (A-S Medication Solutions), MEFLOQUINE HYDROCHLORIDE (Chartwell RX), MEFLOQUINE HYDROCHLORIDE (Hikma Pharmaceuticals USA), MEFLOQUINE HYDROCHLORIDE (Teva Pharmaceuticals USA)
Formula
C17H16F6N2O. HCl
Exact mass
414.0934
Mol weight
414.77
Structure
Simcomp
Class
Metabolizing enzyme substrate
 DG01633  CYP3A/CYP3A4 substrate
Remark
Therapeutic category: 6419
ATC code: P01BC02
Chemical structure group: DG01020
Product (DG01020): D00831<JP/US>
Efficacy
Antimalarial
  Disease
Malaria [DS:H00361]
Comment
Methanolquinoline
Metabolism
Enzyme: CYP3A [HSA:1576 1577 1551]
Interaction
Structure map
map07025  Quinolines
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 P ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
  P01 ANTIPROTOZOALS
   P01B ANTIMALARIALS
    P01BC Methanolquinolines
     P01BC02 Mefloquine
      D00831  Mefloquine hydrochloride (JP18/USP) <JP/US>
USP drug classification [BR:br08302]
 Antiparasitics
  Antiprotozoals
   Mefloquine
    D00831  Mefloquine hydrochloride (JP18/USP)
Therapeutic category of drugs in Japan [BR:br08301]
 6  Agents against pathologic organisms and parasites
  64  Parasitics (systemic)
   641  Antiprotozoans
    6419  Others
     D00831  Mefloquine hydrochloride (JP18/USP)
Drug groups [BR:br08330]
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG01020  Mefloquine
    D00831  Mefloquine hydrochloride
Antimicrobials [BR:br08307]
 Antiparasitics
  Antmalarials
   Methanolquinoline
    D00831  Mefloquine hydrochloride (JP18/USP) <JP/US>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00831  Mefloquine hydrochloride
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D00831
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D00831
Drug groups [BR:br08330]
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG01020  Mefloquine
Other DBs
CAS: 51773-92-3
PubChem: 7847896
ChEBI: 6719
LigandBox: D00831
NIKKAJI: J299.330I
LinkDB
KCF data

ATOM        27
            1   C8y C    16.2139  -17.5612
            2   C8y C    16.2371  -16.1629
            3   C8y C    14.9852  -18.2456
            4   N5x N    17.4131  -18.2807
            5   C8y C    17.4541  -15.4843
            6   C8x C    15.0321  -15.4375
            7   C8x C    13.7802  -17.5261
            8   C1d C    14.9736  -19.6440
            9   C8y C    18.6359  -17.5963
            10  C8x C    18.6535  -16.1979
            11  C1c C    17.4365  -14.0802
            12  C8x C    13.7975  -16.1162
            13  X   F    13.6395  -19.6381
            14  X   F    16.4419  -19.6440
            15  X   F    14.9619  -21.0481
            16  C1d C    19.8352  -18.3101
            17  C1y C    18.6535  -13.3781
            18  O1a O    16.2197  -13.3838
            19  X   F    21.0405  -19.0121
            20  X   F    20.5256  -17.0931
            21  X   F    19.1274  -19.5211
            22  C1x C    19.8704  -14.0802
            23  N1x N    18.6535  -11.9740
            24  C1x C    21.0874  -13.3721
            25  C1x C    19.8704  -11.2719
            26  C1x C    21.0874  -11.9681
            27  X   Cl   23.6498  -15.1039
BOND        28
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 2
            9     5  10 2
            10    5  11 1
            11    6  12 2
            12    8  13 1
            13    8  14 1
            14    8  15 1
            15    9  16 1
            16   11  17 1
            17   11  18 1 #Down
            18   16  19 1
            19   16  20 1
            20   16  21 1
            21   17  22 1
            22   17  23 1
            23   22  24 1
            24   23  25 1
            25   24  26 1
            26    7  12 1
            27    9  10 1
            28   25  26 1

» Japanese version   » Back

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