KEGG   DRUG: Bremelanotide acetate
Entry
D11629                      Drug                                   

Name
Bremelanotide acetate (USAN);
Vyleesi (TN)
Product
Formula
C50H68N14O10. C2H4O2
Exact mass
1084.5454
Mol weight
1085.2147
Structure
Remark
ATC code: G02CX05
Chemical structure group: DG03063
Product (DG03063): D11629<US>
Efficacy
Melanocortin receptor agonist
Comment
Treatment of premenopausal women with acquired, generalized hypoactive sexual desire disorder (HSDD)
Target
MC4R [HSA:4160] [KO:K04202]
MC1R [HSA:4157] [KO:K04199]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04916  Melanogenesis
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G02 OTHER GYNECOLOGICALS
   G02C OTHER GYNECOLOGICALS
    G02CX Other gynecologicals
     G02CX05 Bremelanotide
      D11629  Bremelanotide acetate (USAN) <US>
USP drug classification [BR:br08302]
 Sexual Disorder Agents
  Sexual Disorder Agents (Female)
   Bremelanotide
    D11629  Bremelanotide acetate (USAN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Melanocortin
    MC1R
     D11629  Bremelanotide acetate (USAN) <US>
    MC4R
     D11629  Bremelanotide acetate (USAN) <US>
Other DBs
CAS: 1607799-13-2
PubChem: 405226496
ChEMBL: CHEMBL4297533
LinkDB
KCF data

ATOM        78
            1   C1a C     7.4583  -13.4526
            2   C5a C     8.7129  -12.6859
            3   N1b N     9.8978  -13.4526
            4   C1c C    11.0828  -12.6859
            5   C5a C    12.3374  -13.4526
            6   N1b N    13.5223  -12.6859
            7   C1c C    14.7769  -13.4526
            8   C1b C    15.9618  -12.6859
            9   O6a O    18.4014  -12.6859
            10  C6a C    19.5863  -13.4526
            11  C1c C    20.7712  -12.6859
            12  N1b N    22.0258  -13.4526
            13  O5a O     8.7129  -11.2919
            14  C1b C    11.0828  -11.2919
            15  O5a O    12.3374  -14.8466
            16  C5a C    14.7769  -14.8466
            17  N1b N    15.9618  -15.5436
            18  O5a O    13.5223  -15.5436
            19  C1c C    15.9618  -16.9376
            20  C5a C    15.9618  -11.2919
            21  O5a O    14.7072  -10.5949
            22  N1b N    17.1468  -10.6646
            23  C1b C    19.9348  -10.6646
            24  C1b C    19.2378   -9.4099
            25  C1b C    17.8438   -9.4099
            26  C1b C    20.7712  -11.2919
            27  O6a O    19.5863  -14.8466
            28  C5a C    22.0258  -14.8466
            29  C1b C    12.3374  -10.5949
            30  C1b C    12.3374   -9.2008
            31  C1a C    13.5223   -8.5038
            32  C1c C    23.2107  -15.5436
            33  O5a O    20.8409  -15.5436
            34  C1b C    24.3957  -14.8466
            35  N1b N    23.2107  -16.9376
            36  C5a C    22.0258  -17.6347
            37  O5a O    20.7712  -16.9376
            38  C1c C    22.0258  -19.0287
            39  C8y C    25.5806  -15.5436
            40  C8x C    25.5806  -16.9376
            41  N4x N    26.9746  -17.3559
            42  C8y C    27.7413  -16.2406
            43  C8y C    26.9746  -15.0557
            44  C8x C    29.1353  -16.2406
            45  C8x C    29.8323  -14.9860
            46  C8x C    29.1353  -13.8011
            47  C8x C    27.7413  -13.8011
            48  C1b C    23.2107  -19.7257
            49  N1b N    20.8409  -19.7257
            50  C5a C    19.5863  -19.0287
            51  C1c C    18.4014  -19.7257
            52  O5a O    19.5863  -17.6347
            53  C1b C    24.4654  -19.0287
            54  C1b C    25.5806  -19.7257
            55  N1b N    26.8352  -19.0287
            56  C2c C    28.0201  -19.7257
            57  N1a N    29.2050  -19.0287
            58  N2a N    28.0201  -21.1197
            59  N1b N    17.2165  -19.0287
            60  C1b C    18.4014  -21.1197
            61  C8y C    19.6560  -21.8167
            62  C8x C    19.6560  -23.2107
            63  C8x C    20.8409  -23.9078
            64  C8x C    22.0955  -23.2107
            65  C8x C    22.0955  -21.8167
            66  C8x C    20.8409  -21.1197
            67  C5a C    17.2165  -17.6347
            68  O5a O    18.4711  -16.8679
            69  C1b C    14.7769  -17.6347
            70  C8y C    14.7769  -19.0287
            71  C8x C    13.6617  -19.8651
            72  N5x N    14.0799  -21.1894
            73  C8x C    15.4739  -21.1894
            74  N4x N    15.8921  -19.7954
            75  C6a C    34.1600  -17.1500
            76  O6a O    35.3724  -17.8500
            77  C1a C    32.9476  -17.8500
            78  O6a O    34.1600  -15.7500
BOND        81
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     7   6 1 #Up
            7     7   8 1
            8     9  10 1
            9    11  10 1 #Down
            10   11  12 1
            11    2  13 2
            12    4  14 1 #Up
            13    5  15 2
            14    7  16 1
            15   16  17 1
            16   16  18 2
            17   17  19 1
            18    8  20 1
            19   20  21 2
            20   20  22 1
            21   23  24 1
            22   24  25 1
            23   22  25 1
            24   11  26 1
            25   26  23 1
            26   10  27 2
            27   12  28 1
            28   14  29 1
            29   29  30 1
            30   30  31 1
            31   28  32 1
            32   28  33 2
            33   32  34 1 #Down
            34   32  35 1
            35   35  36 1
            36   36  37 2
            37   36  38 1
            38   34  39 1
            39   39  40 2
            40   40  41 1
            41   41  42 1
            42   42  43 1
            43   39  43 1
            44   42  44 2
            45   44  45 1
            46   45  46 2
            47   46  47 1
            48   47  43 2
            49   38  48 1 #Down
            50   38  49 1
            51   49  50 1
            52   50  51 1
            53   50  52 2
            54   48  53 1
            55   53  54 1
            56   54  55 1
            57   55  56 1
            58   56  57 1
            59   56  58 2
            60   51  59 1
            61   51  60 1 #Up
            62   60  61 1
            63   61  62 2
            64   62  63 1
            65   63  64 2
            66   64  65 1
            67   65  66 2
            68   61  66 1
            69   59  67 1
            70   67  19 1
            71   67  68 2
            72   19  69 1 #Down
            73   69  70 1
            74   70  71 2
            75   71  72 1
            76   72  73 2
            77   73  74 1
            78   70  74 1
            79   75  76 1
            80   75  77 1
            81   75  78 2

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