KEGG   DRUG: D09535Help
Entry
D09535                      Drug                                   

Name
Mirabegron (USAN/JAN);
Myrbetriq (TN)
Product
Formula
C21H24N4O2S
Exact mass
396.162
Mol weight
396.5059
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Therapeutic category: 
ATC code: 
Target
beta3-adrenergic receptor agonist [HSA:155] [KO:K04143]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04144  Endocytosis
hsa04970  Salivary secretion  
 
Interaction
CYP inhibition: CYP2D6 [HSA:1565]
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G04 UROLOGICALS
   G04B UROLOGICALS
    G04BD Urinary antispasmodics
     G04BD12 Mirabegron
      D09535  Mirabegron (USAN/JAN)
USP drug classification [BR:br08302]
 Genitourinary Agents
  Antispasmodics, Urinary
   Mirabegron
    D09535  Mirabegron (USAN/JAN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta3-adrenergic receptor
     Mirabegron
      D09535  Mirabegron (USAN/JAN)
BRITE hierarchy
Other DBs
CAS: 
223673-61-8
PubChem: 
LigandBox: 
KCF data Show

ATOM        28
            1   C8x C    16.1700  -31.5700
            2   C8x C    16.1700  -30.1700
            3   C8x C    17.3600  -29.4700
            4   C8x C    18.6200  -30.1700
            5   C8y C    18.6200  -31.5700
            6   C8x C    17.3600  -32.2700
            7   C1c C    19.8100  -32.2700
            8   C1b C    21.0000  -31.5700
            9   N1b N    22.1900  -32.2700
            10  C1b C    23.3800  -31.5700
            11  C1b C    24.5700  -32.2700
            12  C8y C    25.7600  -31.5700
            13  C8x C    25.7600  -30.1700
            14  C8x C    27.0200  -29.4700
            15  C8y C    28.2100  -30.1700
            16  C8x C    28.2100  -31.5700
            17  C8x C    27.0200  -32.2700
            18  N1b N    29.4000  -29.4700
            19  C5a C    30.5900  -30.1700
            20  O5a O    30.5900  -31.5700
            21  O1a O    19.8100  -33.6700
            22  C1b C    31.8053  -29.4749
            23  C8y C    32.9937  -30.1677
            24  C8x C    33.4144  -31.4976
            25  S2x S    34.8140  -31.5091
            26  C8y C    35.2575  -30.1815
            27  N5x N    34.1319  -29.3495
            28  N1a N    36.6163  -29.7524
BOND        30
            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     5   7 1
            8     7   8 1
            9     8   9 1
            10    9  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   15  18 1
            20   18  19 1
            21   19  20 2
            22    7  21 1 #Down
            23   19  22 1
            24   22  23 1
            25   23  24 2
            26   24  25 1
            27   25  26 1
            28   26  27 2
            29   23  27 1
            30   26  28 1

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