KEGG   DRUG: Anamorelin hydrochloride
Entry
D08856                      Drug                                   
Name
Anamorelin hydrochloride (JAN/USAN);
Adlumiz (TN)
Formula
C31H42N6O3. HCl
Exact mass
582.3085
Mol weight
583.1645
Structure
Class
Metabolizing enzyme substrate
 DG01633  CYP3A/CYP3A4 substrate
  DG02913  CYP3A4 substrate
Remark
Therapeutic category: 3999
Product: D08856<JP>
Efficacy
Antineoplastic, Growth hormone secretagogue receptor (GHSR) agonist
Comment
Anamorelin is a non-peptidic ghrelin [CPD:C16025] mimetic
Treatment of cancer anorexia and cancer cachexia
Target
GHSR [HSA:2693] [KO:K04284]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
Metabolism
Enzyme: CYP3A4 [HSA:1576]
Interaction
Brite
Therapeutic category of drugs in Japan [BR:br08301]
 3  Agents affecting metabolism
  39  Other agents affecting metabolism
   399  Miscellaneous
    3999  Others
     D08856  Anamorelin hydrochloride (JAN/USAN)
Drug groups [BR:br08330]
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG02913  CYP3A4 substrate
    D08856  Anamorelin hydrochloride
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Ghrelin
    GHSR
     D08856  Anamorelin hydrochloride (JAN/USAN) <JP>
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D08856
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D08856
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D08856
Other DBs
CAS: 861998-00-7
PubChem: 96025539
LigandBox: D08856
LinkDB
KCF data

ATOM        41
            1   N1y N    20.6417  -13.6668
            2   C1x C    20.6417  -15.0758
            3   C1x C    21.8620  -15.7803
            4   C1x C    23.0822  -15.0758
            5   C1z C    23.0822  -13.6668
            6   C1x C    21.8620  -12.9623
            7   C5a C    19.4216  -12.9623
            8   C1c C    18.2013  -13.6668
            9   N1b N    16.9811  -12.9623
            10  C5a C    15.7609  -13.6668
            11  C1d C    14.5407  -12.9623
            12  O5a O    19.4216  -11.5535
            13  C1a C    13.3204  -12.2579
            14  N1a N    15.2451  -11.7421
            15  C1a C    13.8361  -14.1825
            16  C1b C    18.2013  -15.0756
            17  O5a O    15.7609  -15.0757
            18  C5a C    23.7867  -12.4466
            19  N1c N    25.2207  -12.4462
            20  O5a O    23.0983  -11.2542
            21  C1a C    25.9356  -13.6834
            22  N1c N    25.9150  -11.2430
            23  C1a C    27.3340  -11.2424
            24  C1a C    25.2250  -10.0490
            25  C1b C    24.4911  -13.6668
            26  C8y C    25.2017  -14.8979
            27  C8x C    24.5162  -16.0846
            28  C8x C    25.2207  -17.3049
            29  C8x C    26.6297  -17.3051
            30  C8x C    27.3150  -16.1185
            31  C8x C    26.6106  -14.8980
            32  C8y C    19.2444  -16.5864
            33  C8y C    19.6559  -17.9245
            34  C8y C    21.0558  -17.9467
            35  N4x N    21.5094  -16.6222
            36  C8x C    20.3899  -15.7815
            37  C8x C    18.9369  -19.1258
            38  C8x C    19.6176  -20.3491
            39  C8x C    21.0175  -20.3712
            40  C8x C    21.7365  -19.1700
            41  X   Cl   31.0682  -14.8644
BOND        43
            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     1   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12    7  12 2
            13   11  13 1
            14   11  14 1
            15   11  15 1
            16    8  16 1 #Up
            17   10  17 2
            18    5  18 1 #Up
            19   18  19 1
            20   18  20 2
            21   19  21 1
            22   19  22 1
            23   22  23 1
            24   22  24 1
            25    5  25 1 #Down
            26   25  26 1
            27   26  27 2
            28   27  28 1
            29   28  29 2
            30   29  30 1
            31   30  31 2
            32   26  31 1
            33   32  33 1
            34   33  34 1
            35   34  35 1
            36   35  36 1
            37   32  36 2
            38   16  32 1
            39   33  37 2
            40   37  38 1
            41   38  39 2
            42   39  40 1
            43   34  40 2

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