KEGG   DRUG: Tesevatinib
Entry
D11772                      Drug                                   
Name
Tesevatinib (USAN/INN)
Formula
C24H25Cl2FN4O2
Exact mass
490.1339
Mol weight
491.3853
Structure
Class
Antineoplastic
 DG01918  Tyrosine kinase inhibitor
  DG01917  Receptor tyrosine kinase inhibitor
Remark
Chemical structure group: DG03101
Efficacy
Antineoplastic, Receptor tyrosine kinase inhibitor
Comment
Treatment of cancer and polycystic kidney disease
Target
EGFR [HSA:1956] [KO:K04361]
ERBB2 (HER2, CD340) [HSA:2064] [KO:K05083]
EPHB4 [HSA:2050] [KO:K05113]
VEGFR2 (KDR) [HSA:3791] [KO:K05098]
VEGFR3 (FLT4) [HSA:2324] [KO:K05097]
  Pathway
hsa01521  EGFR tyrosine kinase inhibitor resistance
hsa04010  MAPK 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
    DG03101  Tesevatinib
     D11772  Tesevatinib
Target-based classification of drugs [BR:br08310]
 Protein kinases
  Receptor tyrosine kinases (RTK)
   EGFR family
    EGFR
     D11772  Tesevatinib (USAN/INN)
    ERBB2 (HER2, CD340)
     D11772  Tesevatinib (USAN/INN)
   VEGFR family
    VEGFR2 (KDR)
     D11772  Tesevatinib (USAN/INN)
    VEGFR3 (FLT4)
     D11772  Tesevatinib (USAN/INN)
   EPH family
    EPHB4
     D11772  Tesevatinib (USAN/INN)
Drug groups [BR:br08330]
 Antineoplastic
  DG01918  Tyrosine kinase inhibitor
   DG01917  Receptor tyrosine kinase inhibitor
    DG03101  Tesevatinib
Other DBs
CAS: 781613-23-8
PubChem: 405226638
ChEBI: 167674
KCF data

ATOM        33
            1   N1b N    17.7800  -17.7800
            2   C8y C    18.9700  -18.4800
            3   C8y C    18.9700  -19.8800
            4   C8y C    20.2300  -20.5800
            5   C8y C    21.4200  -19.8800
            6   C8x C    21.4200  -18.4800
            7   C8x C    20.2300  -17.7800
            8   X   Cl   20.2300  -21.9800
            9   X   F    17.7800  -20.5800
            10  X   Cl   22.6100  -20.5800
            11  C8y C    17.7800  -16.3800
            12  C8y C    18.9700  -14.2800
            13  C8y C    18.9700  -15.6800
            14  N5x N    16.5200  -15.6800
            15  C8x C    16.5200  -14.2800
            16  N5x N    17.7800  -13.5800
            17  C8x C    20.1600  -13.5800
            18  C8y C    21.4200  -14.2800
            19  C8y C    21.4200  -15.6800
            20  C8x C    20.1600  -16.3800
            21  O2a O    22.6100  -13.5800
            22  C1b C    23.7300  -14.2800
            23  O2a O    22.6100  -16.3800
            24  C1a C    23.7300  -15.6800
            25  C1y C    24.9200  -13.5800
            26  C1x C    25.0600  -12.2500
            27  C1y C    26.4600  -11.9700
            28  C1y C    27.1600  -13.0900
            29  C1x C    26.2500  -14.1400
            30  C1x C    27.3700  -10.9200
            31  N1y N    28.7000  -11.4800
            32  C1x C    28.5600  -12.8100
            33  C1a C    29.8900  -10.7800
BOND        37
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     6   7 2
            7     2   7 1
            8     4   8 1
            9     3   9 1
            10    5  10 1
            11    1  11 1
            12   12  13 2
            13   13  11 1
            14   11  14 2
            15   14  15 1
            16   15  16 2
            17   12  16 1
            18   12  17 1
            19   17  18 2
            20   18  19 1
            21   19  20 2
            22   13  20 1
            23   18  21 1
            24   21  22 1
            25   19  23 1
            26   23  24 1
            27   25  22 1 #Up
            28   25  26 1
            29   26  27 1
            30   27  28 1
            31   28  29 1
            32   25  29 1
            33   27  30 1
            34   30  31 1
            35   31  32 1
            36   28  32 1
            37   31  33 1

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Ontology (2)   
   KEGG BRITE (2)   
Drug (1)   
   KEGG DGROUP (1)   
Chemical substance (2)   
   PubChem (1)   
   ChEBI (1)   
Gene (10)   
   KEGG ORTHOLOGY (5)   
   KEGG GENES (5)   
All databases (15)   

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