KEGG   DRUG: Dordaviprone
Entry
D12733                      Drug                                   
Name
Dordaviprone (USAN/INN)
Formula
C24H26N4O
Exact mass
386.2107
Mol weight
386.49
Structure
Class
Metabolizing enzyme substrate
 DG02919  CYP2B6 substrate
 DG02918  CYP2C8 substrate
 DG01642  CYP2C9 substrate
 DG01644  CYP2D6 substrate
 DG01633  CYP3A/CYP3A4 substrate
  DG02913  CYP3A4 substrate
 DG02925  CYP3A5 substrate
Remark
Chemical structure group: DG03280
Product (DG03280): D12734<US>
Efficacy
Antineoplastic
Target
CLPP [HSA:8192] [KO:K01358]
DRD2 [HSA:1813] [KO:K04145]
Metabolism
Enzyme: CYP3A4 [HSA:1576]; CYP2B6 [HSA:1555], CYP2C8 [HSA:1558], CYP2C9 [HSA:1559], CYP2D6 [HSA:1565], CYP3A5 [HSA:1577]
Interaction
Brite
Drug groups [BR:br08330]
 Metabolizing enzyme substrate
  DG02919  CYP2B6 substrate
   DG03280  Dordaviprone
    D12733  Dordaviprone
  DG02918  CYP2C8 substrate
   DG03280  Dordaviprone
    D12733  Dordaviprone
  DG01642  CYP2C9 substrate
   DG03280  Dordaviprone
    D12733  Dordaviprone
  DG01644  CYP2D6 substrate
   DG03280  Dordaviprone
    D12733  Dordaviprone
  DG01633  CYP3A/CYP3A4 substrate
   DG02913  CYP3A4 substrate
    DG03280  Dordaviprone
     D12733  Dordaviprone
  DG02925  CYP3A5 substrate
   DG03280  Dordaviprone
    D12733  Dordaviprone
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Dopamine
    DRD2
     D12733  Dordaviprone (USAN/INN)
 Peptidases and inhibitors
  Serine peptidases
   ClpP endopeptidase family
    CLPP
     D12733  Dordaviprone (USAN/INN)
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D12733
Drug groups [BR:br08330]
 Metabolizing enzyme substrate
  DG02919  CYP2B6 substrate
   DG03280  Dordaviprone
  DG02918  CYP2C8 substrate
   DG03280  Dordaviprone
  DG01642  CYP2C9 substrate
   DG03280  Dordaviprone
  DG01644  CYP2D6 substrate
   DG03280  Dordaviprone
  DG01633  CYP3A/CYP3A4 substrate
   DG02913  CYP3A4 substrate
    DG03280  Dordaviprone
  DG02925  CYP3A5 substrate
   DG03280  Dordaviprone
Other DBs
CAS: 1616632-77-9
PubChem: 497621146
LinkDB
KCF data

ATOM        29
            1   C8y C    17.6338  -16.5867
            2   C8y C    17.6338  -15.1926
            3   C8y C    18.8188  -14.4955
            4   N4y N    20.0735  -15.1926
            5   C8y C    20.0735  -16.5867
            6   N4y N    18.8188  -17.2838
            7   C1x C    16.4488  -17.2838
            8   C1x C    15.1940  -16.5867
            9   N1y N    15.1940  -15.1926
            10  C1x C    16.4488  -14.4955
            11  C1b C    14.0090  -14.4955
            12  C8y C    12.8240  -15.1926
            13  C8x C    12.8240  -16.5867
            14  C8x C    11.5693  -17.2838
            15  C8x C    10.3843  -16.5867
            16  C8x C    10.3843  -15.1926
            17  C8x C    11.5693  -14.4955
            18  O5x O    18.8188  -13.1014
            19  C1b C    21.2585  -14.4955
            20  C8y C    22.4435  -15.1926
            21  C8y C    23.6286  -14.4955
            22  C8x C    24.8833  -15.1926
            23  C8x C    24.8833  -16.5867
            24  C8x C    23.6983  -17.2838
            25  C8x C    22.4435  -16.5867
            26  C1a C    23.6286  -13.1014
            27  N2x N    21.1191  -17.4929
            28  C1x C    20.4917  -18.8173
            29  C1x C    19.0976  -18.6779
BOND        33
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     1   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    2  10 1
            12    9  11 1
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16   14  15 2
            17   15  16 1
            18   16  17 2
            19   12  17 1
            20    3  18 2
            21    4  19 1
            22   19  20 1
            23   20  21 2
            24   21  22 1
            25   22  23 2
            26   23  24 1
            27   24  25 2
            28   20  25 1
            29   21  26 1
            30    5  27 2
            31   27  28 1
            32   28  29 1
            33    6  29 1

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