(Translated by https://www.hiragana.jp/)
KEGG DRUG: Tinengotinib
KEGG   DRUG: Tinengotinib
Entry
D12545                      Drug                                   
Name
Tinengotinib (USAN/INN)
Formula
C20H19ClN6O
Exact mass
394.1309
Mol weight
394.86
Structure
Efficacy
Antineoplastic
Target
AURKA [HSA:6790] [KO:K11481]
AURKB [HSA:9212] [KO:K11479]
FGFR1 (CD331) [HSA:2260] [KO:K04362]
FGFR2 (CD332) [HSA:2263] [KO:K05093]
FGFR3 (CD333) [HSA:2261] [KO:K05094]
VEGFR1 (FLT1) [HSA:2321] [KO:K05096]
VEGFR2 (KDR) [HSA:3791] [KO:K05098]
VEGFR3 (FLT4) [HSA:2324] [KO:K05097]
JAK1 [HSA:3716] [KO:K11217]
JAK2 [HSA:3717] [KO:K04447]
CSF1R (FMS, CD115) [HSA:1436] [KO:K05090]
  Pathway
hsa04010  MAPK signaling pathway
hsa04151  PI3K-Akt signaling pathway
hsa05200  Pathways in cancer
Brite
Target-based classification of drugs [BR:br08310]
 Protein kinases
  Serine/threonine kinases
   AGC group
    AURKA
     D12545  Tinengotinib (USAN/INN)
    AURKB
     D12545  Tinengotinib (USAN/INN)
  Receptor tyrosine kinases (RTK)
   FGFR family
    FGFR1 (CD331)
     D12545  Tinengotinib (USAN/INN)
    FGFR2 (CD332)
     D12545  Tinengotinib (USAN/INN)
    FGFR3 (CD333)
     D12545  Tinengotinib (USAN/INN)
   VEGFR family
    VEGFR1 (FLT1)
     D12545  Tinengotinib (USAN/INN)
    VEGFR2 (KDR)
     D12545  Tinengotinib (USAN/INN)
    VEGFR3 (FLT4)
     D12545  Tinengotinib (USAN/INN)
  Non-receptor tyrosine kinases
   JAK family
    JAK1
     D12545  Tinengotinib (USAN/INN)
    JAK2
     D12545  Tinengotinib (USAN/INN)
 Cytokines and receptors
  Cytokine receptors
   CSF and other factor receptors
    CSF1R (FMS, CD115)
     D12545  Tinengotinib (USAN/INN)
Other DBs
CAS: 2230490-29-4
PubChem: 497620958
PDB-CCD: KX0[PDBj]
LinkDB
KCF data

ATOM        28
            1   C8x C    21.1400   -9.1000
            2   C8y C    21.1400  -10.5000
            3   C8y C    19.9500  -11.2000
            4   C8x C    18.6900  -10.5000
            5   C8x C    18.6900   -9.1000
            6   C8x C    19.9500   -8.4000
            7   C8y C    19.9500  -12.6000
            8   N5x N    21.0700  -13.5100
            9   C8y C    18.6200  -12.9500
            10  C8y C    17.9900  -14.2100
            11  C8y C    21.0700  -14.9100
            12  N4x N    18.6200  -15.4700
            13  C8y C    19.9500  -15.7500
            14  C8y C    22.1900  -15.7500
            15  N5x N    21.7700  -17.0800
            16  N4x N    20.3700  -17.0800
            17  C1a C    23.5200  -15.2600
            18  C8x C    16.5900  -14.2800
            19  C8y C    15.8200  -13.1600
            20  N5x N    16.4500  -11.9000
            21  C8x C    17.8500  -11.7600
            22  N1y N    14.4200  -13.2300
            23  C1x C    13.7900  -14.4900
            24  C1x C    12.3900  -14.5600
            25  O2x O    11.6200  -13.3700
            26  C1x C    12.2500  -12.1100
            27  C1x C    13.6500  -12.0400
            28  X   Cl   22.3300  -11.2000
BOND        32
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     3   7 1
            8     9  10 1
            9     8  11 1
            10   10  12 1
            11    7   9 1
            12   11  13 2
            13    8   7 2
            14   12  13 1
            15   11  14 1
            16   14  15 2
            17   15  16 1
            18   13  16 1
            19   14  17 1
            20   10  18 2
            21   18  19 1
            22   19  20 2
            23   20  21 1
            24    9  21 2
            25   19  22 1
            26   22  23 1
            27   23  24 1
            28   24  25 1
            29   25  26 1
            30   26  27 1
            31   22  27 1
            32    2  28 1

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