KEGG   DRUG: BenzbromaroneHelp
Entry
D01056                      Drug                                   

Name
Benzbromarone (JP17/USAN/INN);
Uroleap (TN)
Formula
C17H12Br2O3
Exact mass
421.9153
Mol weight
424.0834
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Class
Cyp inhibitor
 DG01643  CYP2C9 inhibitor
Unclassified
 DG02042  Uricosurics
Remark
Therapeutic category: 
ATC code: 
Activity
Gout suppressant, Uricosuric
Target
URAT1 [HSA:116085] [KO:K08208]
Metabolism
Enzyme: CYP2C9 [HSA:1559]
Interaction
CYP inhibition: CYP2C9 [HSA:1559]
Transporter inhibition: ABCC2 [HSA:1244]
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 M MUSCULO-SKELETAL SYSTEM
  M04 ANTIGOUT PREPARATIONS
   M04A ANTIGOUT PREPARATIONS
    M04AB Preparations increasing uric acid excretion
     M04AB03 Benzbromarone
      D01056  Benzbromarone (JP17/USAN/INN)
Therapeutic category of drugs in Japan [BR:br08301]
 3  Agents affecting metabolism
  39  Other agents affecting metabolism
   394  Gout preparations
    3949  Others
     D01056  Benzbromarone (JP17/USAN/INN)
Cytochrome P450 interactions [BR:br08309]
 CYP inhbitors
  CYP2C9
   Benzbromarone
    D01056  Benzbromarone (JP17/USAN/INN)
 CYP substrates
  CYP2C9
   Benzbromarone
    D01056  Benzbromarone (JP17/USAN/INN)
 Transporter inhibitors
  ABCC2
   Benzbromarone
    D01056  Benzbromarone (JP17/USAN/INN)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D01056  Benzbromarone
Antirheumatic and antigout drugs [br08366.html]
 Antigout drugs
  D01056
BRITE hierarchy
Other DBs
CAS: 
3562-84-3
PubChem: 
ChEBI: 
ChEMBL: 
LigandBox: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        22
            1   C8x C    15.0500  -18.8300
            2   C8x C    15.0500  -20.2300
            3   C8x C    16.2624  -20.9300
            4   C8y C    17.4749  -20.2300
            5   C8y C    17.4749  -18.8300
            6   C8x C    16.2624  -18.1300
            7   O2x O    18.8064  -20.6626
            8   C8y C    19.6293  -19.5300
            9   C8y C    18.8064  -18.3974
            10  C1b C    21.0000  -19.5300
            11  C1a C    21.7000  -20.7424
            12  C5a C    19.2376  -17.0706
            13  C8y C    20.6169  -16.7775
            14  C8x C    21.5795  -17.8469
            15  C8y C    22.9490  -17.5561
            16  C8y C    23.3818  -16.2247
            17  C8y C    22.4193  -15.1553
            18  C8x C    21.0498  -15.4461
            19  X   Br   22.8399  -13.8609
            20  O1a O    24.7464  -15.9350
            21  X   Br   23.8974  -18.6098
            22  O5a O    18.3111  -16.0415
BOND        24
            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     4   7 1
            8     7   8 1
            9     8   9 2
            10    5   9 1
            11    8  10 1
            12   10  11 1
            13    9  12 1
            14   12  13 1
            15   13  14 2
            16   14  15 1
            17   15  16 2
            18   16  17 1
            19   17  18 2
            20   13  18 1
            21   17  19 1
            22   16  20 1
            23   15  21 1
            24   12  22 2

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