KEGG   DRUG: GedatolisibHelp
Entry
D10635                      Drug                                   

Name
Gedatolisib (USAN/INN)
Formula
C32H41N9O4
Exact mass
615.3282
Mol weight
615.7258
Structure
Mol fileKCF fileDB search
Efficacy
Antineoplastic, Phosphatidylinositol 3-kinase inhibitor
Target
PIK3C [HSA:5290 5291 5293] [KO:K00922]
MTOR [HSA:2475] [KO:K07203]
  Pathway
hsa04151  PI3K-Akt signaling pathway
hsa05200  Pathways in cancer
Brite
Target-based classification of drugs [BR:br08310]
 Protein kinases
  Serine/threonine kinases
   Other
    MTOR
     D10635  Gedatolisib (USAN/INN)
 Enzymes
  Transferases (EC2)
   Phosphotransferase
    PIK3C
     D10635  Gedatolisib (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 1197160-78-3
PubChem: 254741596
ChEMBL: CHEMBL592445
KCF data Show

ATOM        45
            1   C1x C    12.5300  -12.1800
            2   C1x C    12.5300  -13.5800
            3   N1y N    13.7200  -14.2800
            4   C1x C    14.9800  -13.5800
            5   C1x C    14.9800  -12.1800
            6   O2x O    13.7200  -11.4800
            7   C8y C    13.7200  -15.6800
            8   N5x N    12.5300  -16.3800
            9   C8y C    12.5300  -17.7800
            10  N5x N    13.7200  -18.4800
            11  C8y C    14.9800  -17.7800
            12  N5x N    14.9800  -16.3800
            13  N1y N    11.3400  -18.4800
            14  C1x C    10.1500  -17.7800
            15  C1x C     8.8900  -18.4800
            16  O2x O     8.8900  -19.8800
            17  C1x C    10.0800  -20.5800
            18  C1x C    11.3400  -19.8800
            19  C8y C    16.1700  -18.4800
            20  C8x C    16.1700  -19.8800
            21  C8x C    17.4300  -20.5800
            22  C8y C    18.6200  -19.8800
            23  C8x C    18.6200  -18.4800
            24  C8x C    17.4300  -17.7800
            25  N1b N    19.8100  -20.5800
            26  C5a C    21.0700  -19.8800
            27  O5a O    21.0700  -18.4800
            28  N1b N    22.2600  -20.5800
            29  C8y C    23.4500  -19.8800
            30  C8x C    23.4500  -18.4800
            31  C8x C    24.7100  -20.5800
            32  C8x C    25.9000  -19.8800
            33  C8y C    25.9000  -18.4800
            34  C8x C    24.7100  -17.7800
            35  C1x C    28.3500  -19.8800
            36  N1y N    28.3500  -18.4800
            37  C5a C    27.0900  -17.7800
            38  C1x C    29.5400  -20.5800
            39  C1y C    30.7300  -19.8800
            40  C1x C    30.7300  -18.4800
            41  C1x C    29.5400  -17.7800
            42  N1c N    31.9900  -20.5800
            43  C1a C    33.1800  -19.8800
            44  O5a O    27.0900  -16.3800
            45  C1a C    31.9900  -21.9800
BOND        50
            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     3   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12   11  12 2
            13    7  12 1
            14    9  13 1
            15   13  14 1
            16   14  15 1
            17   15  16 1
            18   16  17 1
            19   17  18 1
            20   13  18 1
            21   11  19 1
            22   19  20 1
            23   20  21 2
            24   21  22 1
            25   22  23 2
            26   23  24 1
            27   19  24 2
            28   22  25 1
            29   25  26 1
            30   26  27 2
            31   26  28 1
            32   28  29 1
            33   29  30 2
            34   29  31 1
            35   31  32 2
            36   32  33 1
            37   33  34 2
            38   30  34 1
            39   35  36 1
            40   36  37 1
            41   33  37 1
            42   35  38 1
            43   38  39 1
            44   39  40 1
            45   40  41 1
            46   36  41 1
            47   39  42 1
            48   42  43 1
            49   37  44 2
            50   42  45 1

» Japanese version   » Back

DBGET integrated database retrieval system