KEGG   DRUG: Quizartinib dihydrochloride
Entry
D09956                      Drug                                   
Name
Quizartinib dihydrochloride (USAN);
Quizartinib hydrochloride (JAN);
Vanflyta (TN)
Product
VANFLYTA (Daiichi Sankyo)
Formula
C29H32N6O4S. 2HCl
Exact mass
632.1739
Mol weight
633.5891
Structure
Simcomp
Class
Antineoplastic
 DG01918  Tyrosine kinase inhibitor
  DG01917  Receptor tyrosine kinase inhibitor
Metabolizing enzyme substrate
 DG01633  CYP3A/CYP3A4 substrate
Remark
Therapeutic category: 4291
ATC code: L01EX11
Chemical structure group: DG01364
Product (DG01364): D09956<JP/US>
Efficacy
Antineoplastic, Receptor tyrosine kinase inhibitor
  Disease
Acute myeloid leukemia (FLT3 internal tandem duplication) [DS:H00003]
Target
FLT3* (CD135) [HSA_VAR:2322v2] [HSA:2322] [KO:K05092]
  Pathway
hsa04640  Hematopoietic cell lineage
hsa05200  Pathways in cancer
Metabolism
Enzyme: CYP3A [HSA:1576 1577 1551]
Interaction
Structure map
map07045  Antineoplastics - protein kinase inhibitors
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L01 ANTINEOPLASTIC AGENTS
   L01E PROTEIN KINASE INHIBITORS
    L01EX Other protein kinase inhibitors
     L01EX11 Quizartinib
      D09956  Quizartinib dihydrochloride (USAN) <JP/US>
USP drug classification [BR:br08302]
 Antineoplastics
  Molecular Target Inhibitors
   Quizartinib
    D09956  Quizartinib dihydrochloride (USAN)
Therapeutic category of drugs in Japan [BR:br08301]
 4  Agents affecting cellular function
  42  Antineoplastics
   429  Miscellaneous
    4291  Other Antitumors
     D09956  Quizartinib dihydrochloride (USAN); Quizartinib hydrochloride (JAN)
Drug groups [BR:br08330]
 Antineoplastic
  DG01918  Tyrosine kinase inhibitor
   DG01917  Receptor tyrosine kinase inhibitor
    DG01364  Quizartinib
     D09956  Quizartinib dihydrochloride
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG01364  Quizartinib
    D09956  Quizartinib dihydrochloride
Target-based classification of drugs [BR:br08310]
 Protein kinases
  Receptor tyrosine kinases (RTK)
   PDGFR family
    FLT3* (CD135) [HSA_VAR:2322v2]
     D09956  Quizartinib dihydrochloride (USAN) <JP/US>
New drug approvals in the USA [br08319.html]
 New molecular entities and new therapeutic biological products
  D09956
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D09956
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D09956
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D09956
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D09956
Pharmacogenomic biomarkers [br08341.html]
 Somatic variations in targeted cancer therapies
  D09956
Drug groups [BR:br08330]
 Antineoplastic
  DG01918  Tyrosine kinase inhibitor
   DG01917  Receptor tyrosine kinase inhibitor
    DG01364  Quizartinib
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG01364  Quizartinib
Other DBs
CAS: 1132827-21-4
PubChem: 135626681
LigandBox: D09956
LinkDB
KCF data

ATOM        42
            1   C1x C    36.8200  -17.7100
            2   O2x O    36.8200  -19.1100
            3   C1x C    35.6300  -19.8100
            4   C1x C    34.3700  -19.1100
            5   N1y N    34.3700  -17.7100
            6   C1x C    35.6300  -17.0100
            7   C1b C    33.1800  -17.0100
            8   C1b C    31.9900  -17.7100
            9   O2a O    30.8000  -17.0100
            10  C8y C    29.6100  -17.7100
            11  C8x C    29.6100  -19.1100
            12  C8x C    28.3500  -19.8100
            13  C8y C    27.1600  -19.1100
            14  C8y C    27.1600  -17.7100
            15  C8x C    28.3500  -17.0100
            16  N4y N    25.8300  -19.5300
            17  C8y C    24.9900  -18.4100
            18  S2x S    25.8300  -17.2900
            19  C8x C    24.9900  -20.6500
            20  C8y C    23.6600  -20.2300
            21  N5x N    23.6600  -18.8300
            22  C8y C    22.4700  -20.9300
            23  C8x C    22.4700  -22.3300
            24  C8x C    21.2800  -23.0300
            25  C8y C    20.0200  -22.3300
            26  C8x C    20.0200  -20.9300
            27  C8x C    21.2800  -20.2300
            28  N1b N    18.8300  -23.0300
            29  C5a C    17.6400  -22.3300
            30  N1b N    16.4500  -23.0300
            31  O5a O    17.6400  -20.9300
            32  C8y C    15.2600  -22.3300
            33  N5x N    13.8600  -22.3300
            34  O2x O    13.3700  -21.0000
            35  C8y C    14.5600  -20.1600
            36  C8x C    15.6800  -21.0000
            37  C1d C    14.5600  -18.7600
            38  C1a C    14.5600  -17.3600
            39  C1a C    15.9600  -18.7600
            40  C1a C    13.1600  -18.7600
            41  X   Cl   31.2200  -22.1900
            42  X   Cl   31.2200  -23.8000
BOND        45
            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     5   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14   13  14 2
            15   14  15 1
            16   10  15 2
            17   13  16 1
            18   16  17 1
            19   17  18 1
            20   14  18 1
            21   16  19 1
            22   19  20 2
            23   20  21 1
            24   17  21 2
            25   20  22 1
            26   22  23 1
            27   23  24 2
            28   24  25 1
            29   25  26 2
            30   26  27 1
            31   22  27 2
            32   25  28 1
            33   28  29 1
            34   29  30 1
            35   29  31 2
            36   30  32 1
            37   32  33 2
            38   33  34 1
            39   34  35 1
            40   35  36 2
            41   32  36 1
            42   35  37 1
            43   37  38 1
            44   37  39 1
            45   37  40 1

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