KEGG   DRUG: D08880Help
Entry
D08880                      Drug                                   

Name
Carfilzomib (JAN/USAN/INN);
Kyprolis (TN)
Product
Formula
C40H57N5O7
Exact mass
719.4258
Mol weight
719.9099
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Treatment of cancer
Remark
ATC code: 
Target
proteasome subunit beta type-5 inhibitor [HSA:5693] [KO:K02737]
  Pathway
hsa03050  Proteasome  
 
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L01 ANTINEOPLASTIC AGENTS
   L01X OTHER ANTINEOPLASTIC AGENTS
    L01XX Other antineoplastic agents
     L01XX45 Carfilzomib
      D08880  Carfilzomib (INN/USAN)
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases
   proteasome subunit beta type-5 (PSMB5) [HSA:5693] [KO:K02737]
    Carfilzomib
     D08880  Carfilzomib (INN/USAN)
BRITE hierarchy
Other DBs
CAS: 
868540-17-4
PubChem: 
LigandBox: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        52
            1   C1b C    11.3830  -17.9082
            2   C5a C    12.5990  -17.2061
            3   N1b N    13.8151  -17.9082
            4   C1c C    15.0311  -17.2061
            5   C5a C    16.2471  -17.9082
            6   N1b N    17.4632  -17.2061
            7   C1c C    18.6793  -17.9082
            8   C5a C    19.8953  -17.2061
            9   N1b N    21.1114  -17.9082
            10  C1c C    22.3274  -17.2061
            11  C5a C    23.5435  -17.9082
            12  N1b N    24.7595  -17.2061
            13  C1c C    25.9755  -17.9082
            14  C5a C    27.1917  -17.2061
            15  N1y N    10.1670  -17.2061
            16  C1z C    28.3193  -17.8990
            17  C1x C    10.1670  -15.8022
            18  C1x C     8.9510  -15.1001
            19  O2x O     7.7348  -15.8020
            20  C1x C     7.7348  -17.2061
            21  C1x C     8.9510  -17.9082
            22  O5a O    27.1409  -15.8023
            23  O5a O    23.5435  -19.3123
            24  O5a O    19.8953  -15.8020
            25  O5a O    16.2471  -19.3123
            26  O5a O    12.5990  -15.8022
            27  C1b C    22.3274  -15.8019
            28  C1b C    15.0311  -15.8019
            29  C1b C    25.9755  -19.3124
            30  C1b C    18.6793  -19.3124
            31  O2x O    29.5378  -17.2392
            32  C1x C    29.5353  -18.6011
            33  C8y C    23.5495  -15.0964
            34  C1b C    16.2492  -15.0987
            35  C8y C    16.2492  -13.6945
            36  C8x C    17.4483  -13.0020
            37  C8x C    17.4481  -11.5979
            38  C8x C    16.2320  -10.8960
            39  C8x C    15.0330  -11.5883
            40  C8x C    15.0331  -12.9925
            41  C8x C    24.7516  -15.7905
            42  C8x C    25.9677  -15.0886
            43  C8x C    25.9679  -13.6845
            44  C8x C    24.7658  -12.9902
            45  C8x C    23.5497  -13.6922
            46  C1c C    19.8953  -20.0145
            47  C1a C    21.0984  -19.3197
            48  C1a C    19.8953  -21.4185
            49  C1c C    27.1916  -20.0145
            50  C1a C    28.3988  -19.3174
            51  C1a C    27.1917  -21.4186
            52  C1a C    28.3193  -16.4948
BOND        55
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   11  12 1
            12   12  13 1
            13   13  14 1
            14    1  15 1
            15   14  16 1
            16   15  17 1
            17   17  18 1
            18   18  19 1
            19   19  20 1
            20   20  21 1
            21   15  21 1
            22   14  22 2
            23   11  23 2
            24    8  24 2
            25    5  25 2
            26    2  26 2
            27   10  27 1 #Up
            28    4  28 1 #Up
            29   13  29 1 #Down
            30    7  30 1 #Down
            31   16  31 1
            32   16  32 1
            33   31  32 1
            34   27  33 1
            35   28  34 1
            36   34  35 1
            37   35  36 2
            38   36  37 1
            39   37  38 2
            40   38  39 1
            41   39  40 2
            42   35  40 1
            43   33  41 2
            44   41  42 1
            45   42  43 2
            46   43  44 1
            47   44  45 2
            48   33  45 1
            49   30  46 1
            50   46  47 1
            51   46  48 1
            52   29  49 1
            53   49  50 1
            54   49  51 1
            55   16  52 1 #Up

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