KEGG   DRUG: D00965Help
Entry
D00965                      Drug                                   

Name
Nilutamide (USAN/INN);
Nilandron (TN)
Product
Formula
C12H10F3N3O4
Exact mass
317.0623
Mol weight
317.2207
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antineoplastic, Antiandrogen [DS:H00024]
Remark
Same as: 
ATC code: 
Comment
Indicaction: Metastatic prostate cancer
Target
androgen receptor antagonist [HSA:367] [KO:K08557]
  Pathway
hsa05200  Pathways in cancer
hsa05215  Prostate cancer  
 
Metabolism
Enzyme: CYP2C19 [HSA:1557]
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
     L02BB02 Nilutamide
      D00965  Nilutamide (USAN/INN)
USP drug classification [BR:br08302]
 Antineoplastics
  Antiandrogens
   Nilutamide
    D00965  Nilutamide (USAN/INN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    androgen receptor
     Nilutamide
      D00965  Nilutamide (USAN/INN)
Antineoplastics [BR:br08308]
 Hormones and hormone antagonist
  Androgen antagonist
   Nilutamide
    D00965  Nilutamide (USAN/INN)
Cytochrome P450 interactions [BR:br08309]
 Substrates
  CYP2C19
   Nilutamide
    D00965  Nilutamide (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 
63612-50-0
PubChem: 
DrugBank: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        22
            1   N1y N    34.9300  -18.0600
            2   C8y C    36.1200  -18.7600
            3   C5x C    33.7400  -18.8300
            4   C5x C    34.5800  -16.6600
            5   C8x C    36.1200  -20.1600
            6   C8x C    37.3800  -18.0600
            7   C1z C    32.6900  -17.9200
            8   O5x O    33.7400  -20.2300
            9   N1x N    33.1800  -16.6600
            10  O5x O    35.5600  -15.6800
            11  C8x C    37.3800  -20.8600
            12  C8y C    38.5700  -18.7600
            13  C1a C    31.7100  -16.9400
            14  C1a C    31.5000  -18.6200
            15  C8y C    38.5700  -20.1600
            16  N2b N    39.7600  -20.8600 #+
            17  O3a O    39.7600  -22.2600
            18  O3a O    41.0200  -20.1600 #-
            19  C1d C    39.7853  -18.0649
            20  X   F    40.9977  -17.3649
            21  X   F    39.0853  -16.8525
            22  X   F    40.4853  -19.2774
BOND        23
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     4  10 2
            10    5  11 1
            11    6  12 2
            12    7  13 1
            13    7  14 1
            14   11  15 2
            15   15  16 1
            16   16  17 2
            17   16  18 1
            18    7   9 1
            19   12  15 1
            20   12  19 1
            21   19  20 1
            22   19  21 1
            23   19  22 1

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