KEGG   DRUG: D03669Help
Entry
D03669                      Drug                                   

Name
Deferasirox (JAN/USAN/INN);
Exjade (TN)
Product
Formula
C21H15N3O4
Exact mass
373.1063
Mol weight
373.3615
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Treatment of iron overload [iron chelator] [DS:H00228]
Remark
Therapeutic category: 
ATC code: 
Drug group: 
Metabolism
Enzyme: UGT1A1 [HSA:54658], UGT1A3 [HSA:54659]
Interaction
CYP induction: CYP3A4 [HSA:1576]
CYP inhibition: CYP1A2 [HSA:1544], CYP2C8 [HSA:1558]
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 V VARIOUS
  V03 ALL OTHER THERAPEUTIC PRODUCTS
   V03A ALL OTHER THERAPEUTIC PRODUCTS
    V03AC Iron chelating agents
     V03AC03 Deferasirox
      D03669  Deferasirox (JAN/USAN/INN)
USP drug classification [BR:br08302]
 Therapeutic Nutrients/Minerals/Electrolytes
  Electrolyte/Mineral Modifiers
   Deferasirox
    D03669  Deferasirox (JAN/USAN/INN)
Therapeutic category of drugs in Japan [BR:br08301]
 3  Agents affecting metabolism
  39  Other agents affecting metabolism
   392  Antidotes
    3929  Others
     D03669  Deferasirox (JAN/USAN/INN)
Cytochrome P450 interactions [BR:br08309]
 Inhbitors
  CYP1A2
   Deferasirox
    D03669  Deferasirox (JAN/USAN/INN)
  CYP2C8
   Deferasirox
    D03669  Deferasirox (JAN/USAN/INN)
  CYP3A4
   Deferasirox
    D03669  Deferasirox (JAN/USAN/INN)
BRITE hierarchy
Other DBs
CAS: 
201530-41-8
PubChem: 
DrugBank: 
LigandBox: 
LinkDB All DBs
KCF data Show

ATOM        28
            1   N5x N     8.9600  -13.9300
            2   C8y C     8.9600  -15.3300
            3   N5x N    10.2915  -15.7626
            4   N4y N    11.1144  -14.6300
            5   C8y C    10.2915  -13.4974
            6   C8y C    12.5144  -14.6300
            7   C8x C    13.2182  -15.8492
            8   C8x C    14.6182  -15.8492
            9   C8y C    15.3183  -14.6368
            10  C8x C    14.6145  -13.4177
            11  C8x C    13.2145  -13.4176
            12  C6a C    16.7300  -14.6370
            13  O6a O    17.4331  -13.4194
            14  O6a O    17.4269  -15.8442
            15  C8y C     7.7476  -16.0300
            16  C8x C     6.5521  -15.3396
            17  C8x C     5.3396  -16.0395
            18  C8x C     5.3394  -17.4395
            19  C8x C     6.5349  -18.1299
            20  C8y C     7.7474  -17.4300
            21  O1a O     8.9766  -18.1400
            22  C8y C    10.2915  -12.0974
            23  C8x C    11.4973  -11.4012
            24  C8x C    11.4974  -10.0012
            25  C8x C    10.2850   -9.3012
            26  C8x C     9.0791   -9.9973
            27  C8y C     9.0791  -11.3973
            28  O1a O     7.8771  -12.0915
BOND        31
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 1
            5     1   5 2
            6     4   6 1
            7     6   7 2
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11   10  11 2
            12    6  11 1
            13    9  12 1
            14   12  13 2
            15   12  14 1
            16    2  15 1
            17   15  16 2
            18   16  17 1
            19   17  18 2
            20   18  19 1
            21   19  20 2
            22   15  20 1
            23   20  21 1
            24    5  22 1
            25   22  23 2
            26   23  24 1
            27   24  25 2
            28   25  26 1
            29   26  27 2
            30   22  27 1
            31   27  28 1

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