KEGG   DRUG: Glasdegib maleate
Entry
D11107                      Drug                                   
Name
Glasdegib maleate (JAN);
Daurismo (TN)
Product
DAURISMO (Pfizer Laboratories Div Pfizer)
Formula
C21H22N6O. C4H4O4
Exact mass
490.1965
Mol weight
490.5111
Structure
Simcomp
Class
Antineoplastic
 DG01566  Hedgehog signaling inhibitor
Remark
ATC code: L01XJ03
Chemical structure group: DG02912
Product (DG02912): D11107<US>
Efficacy
Antineoplastic, Smoothened receptor antagonist
  Disease
Acute myeloid leukemia [DS:H00003]
Target
SMO [HSA:6608] [KO:K06226]
  Pathway
hsa04340  Hedgehog signaling pathway
hsa05200  Pathways in cancer
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L01 ANTINEOPLASTIC AGENTS
   L01X OTHER ANTINEOPLASTIC AGENTS
    L01XJ Hedgehog pathway inhibitors
     L01XJ03 Glasdegib
      D11107  Glasdegib maleate (JAN) <US>
USP drug classification [BR:br08302]
 Antineoplastics
  Molecular Target Inhibitors
   Glasdegib
    D11107  Glasdegib maleate (JAN)
Drug groups [BR:br08330]
 Antineoplastic
  DG01566  Hedgehog signaling inhibitor
   DG02912  Glasdegib
    D11107  Glasdegib maleate
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Frizzled / Smoothened family
   Smoothened
    SMO
     D11107  Glasdegib maleate (JAN) <US>
New drug approvals in the USA [br08319.html]
 New molecular entities and new therapeutic biological products
  D11107
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D11107
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D11107
Drug groups [BR:br08330]
 Antineoplastic
  DG01566  Hedgehog signaling inhibitor
   DG02912  Glasdegib
Other DBs
PubChem: 376219031
LinkDB
KCF data

ATOM        36
            1   C1y C    15.6185  -15.0605
            2   C8x C     9.8315  -14.3633
            3   C8x C     9.8315  -15.7577
            4   C8x C    11.0168  -16.4549
            5   C8y C    12.2718  -15.7577
            6   C8y C    12.2718  -14.3633
            7   C8x C    11.0168  -13.5963
            8   N4x N    13.6663  -16.1761
            9   C8y C    14.4333  -15.0605
            10  N5x N    13.6663  -13.8752
            11  C1x C    16.3158  -16.2458
            12  C1y C    17.7102  -16.2458
            13  C1x C    18.4075  -15.0605
            14  C1x C    17.7102  -13.8055
            15  N1y N    16.3158  -13.8055
            16  N1b N    18.4075  -17.5008
            17  C5a C    19.8019  -17.5008
            18  O5a O    20.4992  -16.2458
            19  N1b N    20.4992  -18.6861
            20  C8y C    21.8936  -18.6861
            21  C8x C    22.6606  -19.8714
            22  C8x C    24.0550  -19.8714
            23  C8y C    24.7523  -18.6861
            24  C8x C    24.0550  -17.5008
            25  C8x C    22.6606  -17.5008
            26  C3b C    26.1467  -18.6861
            27  N3a N    27.5412  -18.6861
            28  C1a C    15.6185  -12.5504
            29  C2b C    25.1300  -12.5300
            30  C2b C    26.5300  -12.5300
            31  C6a C    24.4300  -13.7424
            32  C6a C    27.2300  -13.7424
            33  O6a O    28.6298  -13.7424
            34  O6a O    26.5396  -14.9379
            35  O6a O    23.0302  -13.7424
            36  O6a O    25.1204  -14.9379
BOND        38
            1     2   3 2
            2     3   4 1
            3     4   5 2
            4     5   6 1
            5     6   7 2
            6     2   7 1
            7     5   8 1
            8     8   9 1
            9     9  10 2
            10    6  10 1
            11    1   9 1 #Down
            12    1  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   14  15 1
            17    1  15 1
            18   12  16 1 #Up
            19   16  17 1
            20   17  18 2
            21   17  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   23  26 1
            30   26  27 3
            31   15  28 1
            32   29  30 2
            33   29  31 1
            34   30  32 1
            35   32  33 2
            36   32  34 1
            37   31  35 1
            38   31  36 2

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