KEGG   DRUG: Capmatinib
Entry
D10696                      Drug                                   
Name
Capmatinib (USAN/INN)
Formula
C23H17FN6O
Exact mass
412.1448
Mol weight
412.4191
Structure
Simcomp
Class
Antineoplastic
 DG01918  Tyrosine kinase inhibitor
  DG01917  Receptor tyrosine kinase inhibitor
Metabolizing enzyme substrate
 DG01633  CYP3A/CYP3A4 substrate
  DG02913  CYP3A4 substrate
 DG02953  AOX1 substrate
Remark
ATC code: L01EX17
Chemical structure group: DG02081
Product (DG02081): D10891<JP/US>
Efficacy
Antineoplastic, Receptor tyrosine kinase inhibitor
Target
MET [HSA:4233] [KO:K05099]
  Pathway
hsa04014  Ras signaling pathway
hsa04151  PI3K-Akt signaling pathway
hsa05200  Pathways in cancer
Metabolism
Enzyme: CYP3A4 [HSA:1576], AOX1 [HSA:316]
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L01 ANTINEOPLASTIC AGENTS
   L01E PROTEIN KINASE INHIBITORS
    L01EX Other protein kinase inhibitors
     L01EX17 Capmatinib
      D10696  Capmatinib (USAN/INN)
Drug groups [BR:br08330]
 Antineoplastic
  DG01918  Tyrosine kinase inhibitor
   DG01917  Receptor tyrosine kinase inhibitor
    DG02081  Capmatinib
     D10696  Capmatinib
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG02913  CYP3A4 substrate
    DG02081  Capmatinib
     D10696  Capmatinib
  DG02953  AOX1 substrate
   DG02081  Capmatinib
    D10696  Capmatinib
Target-based classification of drugs [BR:br08310]
 Protein kinases
  Receptor tyrosine kinases (RTK)
   MET family
    MET
     D10696  Capmatinib (USAN/INN)
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D10696
Drug groups [BR:br08330]
 Antineoplastic
  DG01918  Tyrosine kinase inhibitor
   DG01917  Receptor tyrosine kinase inhibitor
    DG02081  Capmatinib
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG02913  CYP3A4 substrate
    DG02081  Capmatinib
  DG02953  AOX1 substrate
   DG02081  Capmatinib
Other DBs
CAS: 1029712-80-8
PubChem: 254741657
LinkDB
KCF data

ATOM        31
            1   C8y C    15.2600  -35.4900
            2   C8y C    15.2600  -36.8900
            3   C8x C    16.4724  -37.5900
            4   C8x C    17.6849  -36.8900
            5   C8y C    17.6849  -35.4900
            6   C8x C    16.4724  -34.7900
            7   C8y C    18.9160  -34.7790
            8   X   F    14.0476  -34.7900
            9   C5a C    14.0476  -37.5900
            10  N1b N    12.8521  -36.8996
            11  O5a O    14.0475  -38.9898
            12  C1a C    11.6647  -37.5851
            13  N5x N    20.1212  -35.4747
            14  N4y N    21.3335  -34.7746
            15  C8y C    21.3335  -33.3746
            16  N5x N    20.1283  -32.6789
            17  C8x C    18.9159  -33.3790
            18  C8y C    22.6651  -35.2071
            19  C8x C    23.4879  -34.0745
            20  N5x N    22.6649  -32.9419
            21  C1b C    23.1000  -36.5455
            22  C8y C    24.4683  -36.5563
            23  C8x C    25.1591  -37.7751
            24  C8y C    26.5591  -37.7862
            25  C8y C    27.2687  -36.5794
            26  C8x C    26.5778  -35.3606
            27  C8x C    25.1779  -35.3495
            28  C8x C    27.2494  -39.0042
            29  C8x C    28.6494  -39.0153
            30  C8x C    29.3590  -37.8084
            31  N5x N    28.6686  -36.5905
BOND        35
            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     1   8 1
            9     2   9 1
            10    9  10 1
            11    9  11 2
            12   10  12 1
            13    7  13 2
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   16  17 2
            18    7  17 1
            19   14  18 1
            20   18  19 2
            21   19  20 1
            22   15  20 2
            23   18  21 1
            24   21  22 1
            25   22  23 2
            26   23  24 1
            27   24  25 2
            28   25  26 1
            29   26  27 2
            30   22  27 1
            31   24  28 1
            32   28  29 2
            33   29  30 1
            34   30  31 2
            35   25  31 1

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