KEGG   DRUG: D00961Help
Entry
D00961                      Drug                                   

Name
Bicalutamide (JAN/USP/INN);
Casodex (TN)
Product
  Generic
BICALUTAMIDE (Accord Healthcare), BICALUTAMIDE (American Health Packaging), BICALUTAMIDE (American Health Packaging), BICALUTAMIDE (Apotex Corp.), BICALUTAMIDE (AvKARE), BICALUTAMIDE (Breckenridge Pharmaceutical), BICALUTAMIDE (Bryant Ranch Prepack), BICALUTAMIDE (Cadila Healthcare Limited), BICALUTAMIDE (Dava Pharmaceuticals), BICALUTAMIDE (Golden State Medical Supply), BICALUTAMIDE (Golden State Medical Supply), BICALUTAMIDE (Major Pharmaceuticals), BICALUTAMIDE (Mylan Pharmaceuticals), BICALUTAMIDE (Northstar Rx LLC), BICALUTAMIDE (Physicians Total Care), BICALUTAMIDE (REMEDYREPACK), BICALUTAMIDE (SUN PHARMA GLOBAL), BICALUTAMIDE (Sandoz), BICALUTAMIDE (Synthon Pharmaceuticals), BICALUTAMIDE (Teva Pharmaceuticals USA), BICALUTAMIDE (UDL Laboratories), BICALUTAMIDE (Zydus Pharmaceuticals (USA))
Formula
C18H14F4N2O4S
Exact mass
430.061
Mol weight
430.3734
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antineoplastic, Antiandrogen [DS:H00024]
Remark
Same as: 
Therapeutic category: 
ATC code: 
Drug group: 
Target
androgen receptor antagonist [HSA:367] [KO:K08557]
  Pathway
hsa05200  Pathways in cancer
hsa05215  Prostate cancer  
 
Metabolism
Enzyme: CYP3A4 [HSA:1576]
Interaction
Drug interaction
Structure map
Antineoplastics - hormones
Progesterone, androgen and estrogen receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L02 ENDOCRINE THERAPY
   L02B HORMONE ANTAGONISTS AND RELATED AGENTS
    L02BB Anti-androgens
     L02BB03 Bicalutamide
      D00961  Bicalutamide (JAN/USP/INN)
USP drug classification [BR:br08302]
 Antineoplastics
  Antiandrogens
   Bicalutamide
    D00961  Bicalutamide (JAN/USP/INN)
Therapeutic category of drugs in Japan [BR:br08301]
 4  Agents affecting cellular function
  42  Antineoplastics
   429  Miscellaneous
    4291  Other Antitumors
     D00961  Bicalutamide (JAN/USP/INN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    androgen receptor
     Bicalutamide
      D00961  Bicalutamide (JAN/USP/INN)
Antineoplastics [BR:br08308]
 Hormones and hormone antagonists
  Androgen antagonist
   Bicalutamide
    D00961  Bicalutamide (JAN/USP/INN)
Cytochrome P450 interactions [BR:br08309]
 Substrates
  CYP3A4
   Bicalutamide
    D00961  Bicalutamide (JAN/USP/INN)
 Inhbitors
  CYP3A
   Bicalutamide
    D00961  Bicalutamide (JAN/USP/INN)
BRITE hierarchy
Other DBs
CAS: 
90357-06-5
PubChem: 
DrugBank: 
PDB-CCD: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        29
            1   C8y C    41.7900  -19.3200
            2   C8y C    41.7900  -20.7200
            3   C8x C    40.5300  -18.6200
            4   C1d C    42.9800  -18.6200
            5   C8x C    40.5300  -21.4200
            6   C3b C    42.9800  -21.4200
            7   C8y C    39.3400  -19.3200
            8   X   F    44.1700  -17.9200
            9   X   F    42.2800  -17.4300
            10  X   F    43.6800  -19.8100
            11  C8x C    39.3400  -20.7200
            12  N3a N    44.1700  -22.1200
            13  N1b N    38.1500  -18.6200
            14  C5a C    36.9600  -19.3200
            15  C1d C    35.7000  -18.6200
            16  O5a O    36.9600  -20.7200
            17  C1b C    34.5100  -19.3200
            18  C1a C    35.7000  -17.2200
            19  S4a S    33.3200  -18.6200
            20  C8y C    32.0600  -19.3200
            21  O3c O    32.3400  -17.6400
            22  O3c O    34.2300  -17.5700
            23  O1a O    35.7000  -20.0200
            24  C8x C    32.0600  -20.7200
            25  C8x C    30.8700  -21.4200
            26  C8y C    29.6800  -20.7200
            27  C8x C    29.6800  -19.3200
            28  C8x C    30.8700  -18.6200
            29  X   F    28.4200  -21.4200
BOND        30
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     4   9 1
            9     4  10 1
            10    5  11 1
            11    6  12 3
            12    7  13 1
            13   13  14 1
            14   14  15 1
            15   14  16 2
            16   15  17 1
            17   15  18 1 #Down
            18   17  19 1
            19   19  20 1
            20   19  21 2
            21   19  22 2
            22    7  11 2
            23   15  23 1 #Up
            24   20  24 2
            25   24  25 1
            26   25  26 2
            27   26  27 1
            28   27  28 2
            29   20  28 1
            30   26  29 1

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