KEGG   DRUG: Danuglipron
Entry
D11910                      Drug                                   

Name
Danuglipron (USAN)
Formula
C31H30FN5O4
Exact mass
555.2282
Mol weight
555.5994
Structure
Remark
Chemical structure group: DG03125
Efficacy
Antidiabetic
Comment
Treatment of type 2 diabetes mellitus, obesity and non-alcoholic steatohepatitis (NASH)
Target
GLP1R [HSA:2740] [KO:K04581]
  Pathway
hsa04024  cAMP signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04911  Insulin secretion
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Secretin receptor family
   Glucagon
    GLP1R
     D11910  Danuglipron (USAN)
Other DBs
CAS: 2230198-02-2
ChEMBL: CHEMBL4518483
PDB-CCD: UK4[PDBj]
LinkDB
KCF data

ATOM        41
            1   C8y C    11.1300  -13.5100
            2   C8x C    11.1300  -14.9100
            3   C8y C    12.3424  -15.6100
            4   C8y C    13.5549  -14.9100
            5   C8x C    13.5549  -13.5100
            6   C8x C    12.3424  -12.8100
            7   C3b C     9.9176  -12.8100
            8   N3a N     8.7051  -12.1100
            9   X   F    12.3424  -17.0098
            10  C1b C    14.7860  -15.6210
            11  O2a O    15.9912  -14.9253
            12  C8y C    17.1735  -15.6081
            13  C8x C    17.1734  -17.0098
            14  C8x C    18.3858  -17.7099
            15  C8x C    19.5983  -17.0100
            16  C8y C    19.5984  -15.6083
            17  N5x N    18.3860  -14.9082
            18  C1y C    20.8114  -14.9082
            19  C1x C    22.0084  -15.5996
            20  C1x C    23.2210  -14.8998
            21  N1y N    23.2212  -13.4998
            22  C1x C    22.0242  -12.8084
            23  C1x C    20.8116  -13.5082
            24  C1b C    24.4433  -12.7944
            25  C8y C    25.6523  -13.4926
            26  N4y N    25.5988  -14.9098
            27  C8y C    26.9248  -15.3993
            28  C8y C    27.8001  -14.2893
            29  N5x N    27.0149  -13.1140
            30  C1b C    24.4500  -15.6788
            31  C1y C    24.4500  -17.0788
            32  O2x O    23.4496  -18.0794
            33  C1x C    24.4502  -19.0798
            34  C1x C    25.4506  -18.0792
            35  C8x C    27.4434  -16.6997
            36  C8y C    28.8289  -16.9008
            37  C8x C    29.7041  -15.7908
            38  C8x C    29.1856  -14.4904
            39  C6a C    29.3387  -18.1782
            40  O6a O    30.7186  -18.3781
            41  O6a O    28.4581  -19.2953
BOND        46
            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     1   7 1
            8     7   8 3
            9     3   9 1
            10    4  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 2
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17   16  17 2
            18   12  17 1
            19   16  18 1
            20   18  19 1
            21   19  20 1
            22   20  21 1
            23   21  22 1
            24   22  23 1
            25   18  23 1
            26   21  24 1
            27   24  25 1
            28   25  26 1
            29   26  27 1
            30   27  28 2
            31   28  29 1
            32   25  29 2
            33   26  30 1
            34   31  30 1 #Down
            35   31  32 1
            36   32  33 1
            37   33  34 1
            38   31  34 1
            39   27  35 1
            40   35  36 2
            41   36  37 1
            42   37  38 2
            43   28  38 1
            44   36  39 1
            45   39  40 1
            46   39  41 2

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