KEGG   DRUG: Ziftomenib
Entry
D12419                      Drug                                   
Name
Ziftomenib (USAN/INN)
Formula
C33H42F3N9O2S2
Exact mass
717.2855
Mol weight
717.88
Structure
Efficacy
Antineoplastic, Menin-MLL interaction inhibitor
Comment
Treatment of acute myeloid leukemia
Target
MEN1 [HSA:4221] [KO:K14970]
  Pathway
hsa05202  Transcriptional misregulation in cancer
Brite
Target-based classification of drugs [BR:br08310]
 Not elsewhere classified
  Cellular process
   Chromatin
    MEN1
     D12419  Ziftomenib (USAN/INN)
Other DBs
CAS: 2134675-36-6
PubChem: 497620832
LinkDB
KCF data

ATOM        49
            1   C1x C    18.2700  -13.3000
            2   N1y N    18.2700  -14.7000
            3   C1x C    17.0800  -15.4000
            4   C1x C    15.8200  -14.7000
            5   C1y C    15.8200  -13.3000
            6   C1x C    17.0800  -12.6000
            7   C1b C    19.4600  -15.4000
            8   C8y C    20.6500  -14.7000
            9   C8x C    20.6500  -13.3000
            10  C8x C    21.9100  -12.6000
            11  C8y C    23.1000  -13.3000
            12  C8y C    23.1000  -14.7000
            13  C8y C    21.9100  -15.4000
            14  C1a C    21.9100  -16.8000
            15  N4y N    24.4300  -12.8800
            16  C8y C    25.2700  -14.0000
            17  C8x C    24.4300  -15.1200
            18  C3b C    26.6700  -14.0000
            19  N3a N    28.0700  -14.0000
            20  C1b C    24.8500  -11.5500
            21  C1c C    26.2500  -11.2700
            22  C1a C    27.1600  -12.3200
            23  N1y N    26.6700   -9.9400
            24  C1x C    25.7600   -8.8900
            25  C1x C    26.1800   -7.5600
            26  N1y N    27.5100   -7.2800
            27  C1x C    28.4900   -8.3300
            28  C1x C    28.0000   -9.6600
            29  S4a S    27.9300   -5.9500
            30  C1a C    28.3500   -4.6200
            31  O3c O    29.3300   -6.3000
            32  O3c O    26.6000   -5.6000
            33  N1b N    14.6300  -12.6000
            34  C8y C    14.6300  -11.2000
            35  C8y C    13.4400  -10.5000
            36  C8y C    13.4400   -9.1000
            37  N5x N    14.6300   -8.4000
            38  C8y C    15.8200   -9.1000
            39  N5x N    15.8200  -10.5000
            40  N1b N    17.0100   -8.4000
            41  C1a C    18.2000   -9.1000
            42  C8x C    12.1100  -10.9200
            43  C8y C    11.2700   -9.8000
            44  S2x S    12.1100   -8.6800
            45  C1b C     9.8700   -9.8000
            46  C1d C     9.1700   -8.6100
            47  X   F    10.3600   -7.9100
            48  X   F     7.9800   -9.3100
            49  X   F     8.4700   -7.3500
BOND        54
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     2   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11   10  11 2
            12   11  12 1
            13   12  13 2
            14    8  13 1
            15   13  14 1
            16   11  15 1
            17   15  16 1
            18   16  17 2
            19   12  17 1
            20   16  18 1
            21   18  19 3
            22   15  20 1
            23   20  21 1
            24   21  22 1 #Up
            25   21  23 1
            26   23  24 1
            27   24  25 1
            28   25  26 1
            29   26  27 1
            30   27  28 1
            31   23  28 1
            32   26  29 1
            33   29  30 1
            34   29  31 2
            35   29  32 2
            36    5  33 1
            37   33  34 1
            38   34  35 2
            39   35  36 1
            40   36  37 2
            41   37  38 1
            42   38  39 2
            43   34  39 1
            44   38  40 1
            45   40  41 1
            46   35  42 1
            47   42  43 2
            48   43  44 1
            49   36  44 1
            50   43  45 1
            51   45  46 1
            52   46  47 1
            53   46  48 1
            54   46  49 1

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