KEGG   DRUG: D10176Help
Entry
D10176                      Drug                                   

Name
Trametinib dimethyl sulfoxide (USAN);
Mekinist (TN)
Product
Formula
C26H23FIN5O4. C2H6OS
Exact mass
693.0918
Mol weight
693.5282
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antineoplastic
Remark
ATC code: 
Drug group: 
Target
MEK1/2 inhibitor [HSA:5604 5605] [KO:K04368 K04369]
  Pathway
hsa04010  MAPK signaling pathway
hsa04012  ErbB signaling pathway  
 
Interaction
Genomic biomarker: BRAF [HSA:673]
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L01 ANTINEOPLASTIC AGENTS
   L01X OTHER ANTINEOPLASTIC AGENTS
    L01XE Protein kinase inhibitors
     L01XE25 Trametinib
      D10176  Trametinib dimethyl sulfoxide (USAN)
USP drug classification [BR:br08302]
 Antineoplastics
  Molecular Target Inhibitors
   Trametinib
    D10176  Trametinib dimethyl sulfoxide (USAN)
Target-based classification of drugs [BR:br08310]
 Protein kinases
  Serine/threonine protein kinases: STE group
   STE7 family
    MEK1/2
     Trametinib
      D10176  Trametinib dimethyl sulfoxide (USAN)
BRITE hierarchy
Other DBs
CAS: 
1187431-43-1
PubChem: 
LigandBox: 
LinkDB All DBs
KCF data Show

ATOM        41
            1   C8y C    23.1000  -23.8000
            2   C8y C    23.1000  -25.1300
            3   C8y C    24.2200  -25.8300
            4   N4y N    25.4100  -25.1300
            5   C8y C    25.4100  -23.8000
            6   C8y C    24.2200  -23.1000
            7   C8y C    24.2200  -21.7000
            8   N4y N    23.1000  -21.0000
            9   C8y C    21.8400  -21.7000
            10  N4y N    21.8400  -23.1000
            11  C1y C    23.1000  -19.6000
            12  O5x O    25.4100  -21.0000
            13  O5x O    20.6500  -21.0000
            14  O5x O    24.2200  -27.3000
            15  C1a C    26.6700  -25.9000
            16  N1b N    26.6700  -23.1000
            17  C8y C    27.8600  -23.8000
            18  C8x C    27.8600  -25.1300
            19  C8x C    29.1200  -25.8300
            20  C8y C    30.3100  -25.1300
            21  C8x C    30.3100  -23.8000
            22  C8y C    29.1200  -23.1000
            23  X   F    29.1200  -21.7000
            24  X   I    31.5000  -25.8300
            25  C1a C    21.8400  -25.8300
            26  C8y C    20.6500  -23.8000
            27  C8x C    19.4600  -23.1000
            28  C8y C    18.2700  -23.8000
            29  C8x C    18.2700  -25.2000
            30  C8x C    19.4600  -25.8300
            31  C8x C    20.6500  -25.1300
            32  N1b N    17.0100  -23.1000
            33  C5a C    15.8200  -23.8000
            34  C1a C    14.6300  -23.1000
            35  O5a O    15.8200  -25.1300
            36  C1x C    23.8000  -18.4100
            37  C1x C    22.4000  -18.4100
            38  S4a S    35.9800  -24.3600
            39  C1a C    37.1924  -25.0600
            40  C1a C    34.7676  -25.0600
            41  O3c O    35.9800  -22.9600
BOND        44
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     6   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    1  10 1
            12    8  11 1
            13    7  12 2
            14    9  13 2
            15    3  14 2
            16    4  15 1
            17    5  16 1
            18   16  17 1
            19   17  18 2
            20   18  19 1
            21   19  20 2
            22   20  21 1
            23   21  22 2
            24   17  22 1
            25   22  23 1
            26   20  24 1
            27    2  25 1
            28   10  26 1
            29   26  27 2
            30   27  28 1
            31   28  29 2
            32   29  30 1
            33   30  31 2
            34   26  31 1
            35   28  32 1
            36   32  33 1
            37   33  34 1
            38   33  35 2
            39   36  37 1
            40   37  11 1
            41   11  36 1
            42   38  39 1
            43   38  40 1
            44   38  41 2

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