KEGG   DRUG: Revumenib citrate
Entry
D12729                      Drug                                   
Name
Revumenib citrate (USAN);
Revumenib monocitrate monohydrate;
Revuforj (TN)
Product
REVUFORJ (Syndax Pharmaceuticals)
Formula
C32H47FN6O4S. C6H8O7. H2O
Exact mass
840.3739
Mol weight
840.96
Structure
Remark
ATC code: L01XX87
Chemical structure group: DG03279
Product (DG03279): D12729<US>
Efficacy
Antineoplastic, Menin-MLL interaction inhibitor
  Disease
Acute leukemia (with a KMT2A translocation) [DS:H00003 H00001 H00002]
Acute leukemia (with a NPM1 mutation) [DS:H00003 H00001 H00002]
Target
MEN1 [HSA:4221] [KO:K14970]
  Pathway
hsa05202  Transcriptional misregulation in cancer
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L01 ANTINEOPLASTIC AGENTS
   L01X OTHER ANTINEOPLASTIC AGENTS
    L01XX Other antineoplastic agents
     L01XX87 Revumenib
      D12729  Revumenib citrate (USAN) <US>
USP drug classification [BR:br08302]
 Antineoplastics
  Molecular Target Inhibitors
   Menin Inhibitors
    Revumenib
     D12729  Revumenib citrate (USAN)
Target-based classification of drugs [BR:br08310]
 Not elsewhere classified
  Cellular process
   Chromatin
    MEN1
     D12729  Revumenib citrate (USAN) <US>
New drug approvals in the USA [br08319.html]
 New molecular entities and new therapeutic biological products
  D12729
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D12729
Pharmacogenomic biomarkers [br08341.html]
 Somatic variations in targeted cancer therapies
  D12729
Other DBs
CAS: 2761046-45-9
PubChem: 497621142
LinkDB
KCF data

ATOM        58
            1   C1d C    29.9652  -17.0131
            2   C1b C    28.8450  -17.7133
            3   C1b C    31.1555  -17.7133
            4   C6a C    30.6654  -15.8929
            5   O1a O    29.2651  -15.8929
            6   C6a C    27.6548  -17.0831
            7   C6a C    31.1555  -19.1135
            8   O6a O    29.9652  -14.7026
            9   O6a O    32.2057  -15.8929
            10  O6a O    26.3945  -17.7833
            11  O6a O    27.6548  -15.7529
            12  O6a O    32.5558  -19.8837
            13  O6a O    29.9652  -19.8837
            14  O0  O    27.0199  -12.6000
            15  C8y C    19.8233  -13.7576
            16  C8y C    18.6362  -13.0593
            17  N1y N    17.4490  -13.7576
            18  C1z C    15.4937  -13.7576
            19  C1x C    16.4714  -12.7800
            20  C1x C    16.4714  -14.7353
            21  C1x C    13.3987  -14.9448
            22  N1y N    12.7004  -13.7576
            23  C1x C    13.3987  -12.5705
            24  C1x C    14.7954  -12.5705
            25  C1x C    14.7954  -14.9448
            26  C1b C    11.2339  -13.7576
            27  C1y C    10.5356  -14.9448
            28  C1x C    11.2339  -16.1319
            29  C1x C    10.5356  -17.4587
            30  C1y C     9.1390  -17.4587
            31  C1x C     8.4407  -16.2018
            32  C1x C     9.1390  -14.9448
            33  N1b N     8.4407  -18.6459
            34  S4a S     7.0440  -18.6459
            35  C1b C     5.6474  -18.6459
            36  C1a C     4.9490  -19.8330
            37  O3c O     7.0440  -17.2492
            38  O3c O     7.0440  -20.0425
            39  N5x N    18.6362  -11.6627
            40  C8x C    19.8233  -10.9643
            41  N5x N    21.0803  -11.6627
            42  C8x C    21.0803  -13.0593
            43  C8y C    23.4546  -17.3191
            44  C8x C    23.4546  -15.8526
            45  C8x C    22.2674  -15.1543
            46  C8y C    21.0105  -15.8526
            47  C8y C    21.0105  -17.3191
            48  C8x C    22.2674  -18.0174
            49  O2a O    19.8233  -15.1543
            50  X   F    24.6417  -18.0174
            51  C5a C    19.7535  -18.0174
            52  O5a O    18.6362  -17.3191
            53  N1c N    19.8233  -19.4141
            54  C1b C    21.0105  -20.1124
            55  C1a C    22.1976  -19.4141
            56  C1c C    18.6362  -20.1124
            57  C1a C    17.3792  -19.4141
            58  C1a C    18.6362  -21.5090
BOND        60
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     4   9 2
            9     6  10 1
            10    6  11 2
            11    7  12 1
            12    7  13 2
            13   16  17 1
            14   18  19 1
            15   19  17 1
            16   17  20 1
            17   18  20 1
            18   21  22 1
            19   22  23 1
            20   23  24 1
            21   24  18 1
            22   18  25 1
            23   21  25 1
            24   22  26 1
            25   27  26 1 #Down
            26   27  28 1
            27   28  29 1
            28   29  30 1
            29   30  31 1
            30   31  32 1
            31   27  32 1
            32   30  33 1 #Up
            33   33  34 1
            34   34  35 1
            35   35  36 1
            36   34  37 2
            37   34  38 2
            38   15  16 1
            39   16  39 2
            40   39  40 1
            41   40  41 2
            42   41  42 1
            43   42  15 2
            44   43  44 2
            45   44  45 1
            46   45  46 2
            47   46  47 1
            48   47  48 2
            49   43  48 1
            50   46  49 1
            51   43  50 1
            52   49  15 1
            53   47  51 1
            54   51  52 2
            55   51  53 1
            56   53  54 1
            57   54  55 1
            58   53  56 1
            59   56  57 1
            60   56  58 1

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