KEGG   DRUG: Tasurgratinib
Entry
D12404                      Drug                                   
Name
Tasurgratinib (INN)
Formula
C32H37N5O6
Exact mass
587.2744
Mol weight
587.67
Structure
Class
Antineoplastic
 DG01918  Tyrosine kinase inhibitor
  DG01917  Receptor tyrosine kinase inhibitor
Remark
Chemical structure group: DG03234
Efficacy
Antineoplastic, Receptor tyrosine kinase inhibitor
Target
FGFR1 (CD331) [HSA:2260] [KO:K04362]
FGFR2 (CD332) [HSA:2263] [KO:K05093]
FGFR3 (CD333) [HSA:2261] [KO:K05094]
  Pathway
hsa04014  Ras signaling pathway
hsa04151  PI3K-Akt signaling pathway
hsa05200  Pathways in cancer
Interaction
Brite
Drug groups [BR:br08330]
 Antineoplastic
  DG01918  Tyrosine kinase inhibitor
   DG01917  Receptor tyrosine kinase inhibitor
    DG03234  Tasurgratinib
     D12404  Tasurgratinib
Target-based classification of drugs [BR:br08310]
 Protein kinases
  Receptor tyrosine kinases (RTK)
   FGFR family
    FGFR1 (CD331)
     D12404  Tasurgratinib (INN)
    FGFR2 (CD332)
     D12404  Tasurgratinib (INN)
    FGFR3 (CD333)
     D12404  Tasurgratinib (INN)
Drug groups [BR:br08330]
 Antineoplastic
  DG01918  Tyrosine kinase inhibitor
   DG01917  Receptor tyrosine kinase inhibitor
    DG03234  Tasurgratinib
Other DBs
CAS: 1622204-21-0
PDB-CCD: A1LY1[PDBj]
LinkDB
KCF data

ATOM        43
            1   N1y N    11.1769  -18.4355
            2   C1x C    11.1769  -16.9690
            3   C1x C    12.4339  -16.2707
            4   C1y C    13.6210  -16.9690
            5   C1x C    13.6210  -18.4355
            6   C1x C    12.4339  -19.1338
            7   C1b C     9.9898  -19.1338
            8   C1b C     8.8026  -18.4355
            9   C8y C    14.8081  -16.2707
            10  C8x C    14.8081  -14.8741
            11  C8x C    16.0651  -14.1758
            12  C8y C    17.2522  -14.8741
            13  C8x C    17.2522  -16.2707
            14  C8x C    16.0651  -16.9690
            15  C5a C    18.5092  -14.1758
            16  O1a O     7.5875  -19.1239
            17  O5a O    18.5263  -12.7792
            18  N1b N    19.7085  -14.8914
            19  C8y C    19.7085  -16.2881
            20  N5x N    18.4975  -16.9873
            21  C8x C    18.4975  -18.3839
            22  C8x C    19.7071  -19.0822
            23  C8y C    20.9181  -18.3830
            24  C8x C    20.9181  -16.9864
            25  O2a O    22.0941  -19.0620
            26  C8y C    23.2850  -18.3742
            27  C8x C    24.4703  -19.0586
            28  C8y C    25.6799  -18.3602
            29  C8y C    25.6799  -16.9636
            30  C8x C    24.4945  -16.2794
            31  C8y C    23.2850  -16.9776
            32  O2a O    22.0513  -16.2652
            33  C1b C    22.0513  -14.8686
            34  C1b C    23.2728  -14.1633
            35  C8x C    27.0080  -18.7919
            36  C8x C    27.8291  -17.6619
            37  N4y N    27.0081  -16.5321
            38  C5a C    27.4365  -15.2142
            39  N1b N    28.8114  -14.9222
            40  O5a O    26.5115  -14.1867
            41  C1a C    29.7711  -15.9887
            42  O2a O    23.2732  -12.7404
            43  C1a C    24.4609  -12.0548
BOND        47
            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     1   7 1
            8     7   8 1
            9     4   9 1
            10    9  10 2
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14   13  14 2
            15    9  14 1
            16   12  15 1
            17    8  16 1
            18   15  17 2
            19   15  18 1
            20   18  19 1
            21   19  20 2
            22   20  21 1
            23   21  22 2
            24   22  23 1
            25   23  24 2
            26   19  24 1
            27   23  25 1
            28   25  26 1
            29   26  27 2
            30   27  28 1
            31   28  29 2
            32   29  30 1
            33   30  31 2
            34   26  31 1
            35   31  32 1
            36   32  33 1
            37   33  34 1
            38   28  35 1
            39   35  36 2
            40   36  37 1
            41   29  37 1
            42   37  38 1
            43   38  39 1
            44   38  40 2
            45   39  41 1
            46   34  42 1
            47   42  43 1

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