KEGG   DRUG: SofosbuvirHelp
Entry
D10366                      Drug                                   

Name
Sofosbuvir (JAN/USAN);
Sovaldi (TN)
Product
Formula
C22H29FN3O9P
Exact mass
529.1625
Mol weight
529.4525
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antiviral
 DG02000  NS5B inhibitor
Transporter substrate
 DG01913  ABCG2 substrate
Remark
Therapeutic category: 6250
ATC code: J05AP08
Product: D10366<JP/US>
Product (mixture): D10578<JP/US> D10900<US> D10827<US>
Efficacy
Antiviral, NS5B polymerase inhibitor
  Disease
Chronic hepatitis C virus infection [DS:H00413]
Target
NS5B [KO:K22472]
  Pathway
ko05160  Hepatitis C
Metabolism
Transporter: ABCB1 [HSA:5243], ABCG2 [HSA:9429]
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J05 ANTIVIRALS FOR SYSTEMIC USE
   J05A DIRECT ACTING ANTIVIRALS
    J05AP Antivirals for treatment of HCV infections
     J05AP08 Sofosbuvir
      D10366  Sofosbuvir (JAN/USAN) <JP/US>
USP drug classification [BR:br08302]
 Antivirals
  Anti-hepatitis C (HCV) Agents, Direct Acting
   Sofosbuvir
    D10366  Sofosbuvir (JAN/USAN)
Therapeutic category of drugs in Japan [BR:br08301]
 6  Agents against pathologic organisms and parasites
  62  Chemotherapeutics
   625  Antivirals
    6250  Antivirals
     D10366  Sofosbuvir (JAN/USAN)
Antiinfectives [br08350.html]
 Antivirals
  D10366
New drug approvals in the USA [br08319.html]
 New Molecular Entity and New Therapeutic Biological Product Approvals
  D10366
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D10366
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D10366
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D10366
Pharmacogenomic biomarkers in FDA drug labels [br08341.html]
 Polymorphisms and germline mutations
  D10366
BRITE hierarchy
Other DBs
CAS: 1190307-88-0
PubChem: 172232459
ChEBI: 85083
ChEMBL: CHEMBL1258950 CHEMBL1259059
LinkDB All DBs
KCF data Show

ATOM        36
            1   C1a C     9.2183  -16.9828
            2   C1c C    10.4121  -17.6720
            3   O7a O    11.6059  -16.9828
            4   C7a C    12.7996  -17.6720
            5   C1c C    13.9933  -16.9828
            6   N1b N    15.1872  -17.6720
            7   C1a C    10.4121  -19.0502
            8   O6a O    12.7996  -19.0504
            9   C1a C    13.9933  -15.6045
            10  C1y C    20.6947  -17.5762
            11  C1y C    21.1222  -18.9240
            12  C1z C    22.5361  -18.9339
            13  C1y C    22.9826  -17.5921
            14  O2x O    21.8444  -16.7531
            15  P1b P    16.9323  -16.9828
            16  O3b O    15.7425  -16.2958
            17  O2b O    18.1300  -16.2913
            18  C8y C    18.1320  -14.9154
            19  C8x C    19.3096  -14.2375
            20  C8x C    19.3114  -12.8591
            21  C8x C    18.1186  -12.1683
            22  C8x C    16.9410  -12.8461
            23  C8x C    16.9392  -14.2245
            24  O2b O    18.3120  -17.6964
            25  C1b C    19.4866  -16.9441
            26  O1a O    20.3166  -20.0168
            27  C1a C    23.8864  -19.4877
            28  X   F    22.1827  -20.1470
            29  N4y N    24.2889  -17.1603
            30  C8x C    25.4710  -17.8949
            31  C8x C    26.6865  -17.2447
            32  C8y C    26.7312  -15.8671
            33  N4x N    25.5490  -15.1324
            34  C8y C    24.3335  -15.7825
            35  O5x O    27.9599  -15.2099
            36  O5x O    23.1649  -15.0563
BOND        38
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     2   7 1
            7     4   8 2
            8     5   9 1 #Down
            9    10  11 1
            10   11  12 1
            11   12  13 1
            12   13  14 1
            13   10  14 1
            14   15  16 2
            15   15  17 1
            16   17  18 1
            17   18  19 2
            18   19  20 1
            19   20  21 2
            20   21  22 1
            21   22  23 2
            22   18  23 1
            23   15  24 1 #Down
            24   24  25 1
            25   10  25 1 #Up
            26   11  26 1 #Down
            27   12  27 1 #Up
            28   12  28 1 #Down
            29   13  29 1 #Up
            30   29  30 1
            31   30  31 2
            32   31  32 1
            33   32  33 1
            34   33  34 1
            35   29  34 1
            36   32  35 2
            37   34  36 2
            38   15   6 1 #Up

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