KEGG   DRUG: Fosamprenavir calcium hydrate
Entry
D02867                      Drug                                   

Name
Fosamprenavir calcium hydrate (JAN);
Lexiva (TN)
Formula
C25H34N3O9PS. Ca. xH2O
Structure
Simcomp
Class
Antiviral
 DG01647  HIV protease inhibitor
Metabolizing enzyme substrate
 DG02913  CYP3A4 substrate
Metabolizing enzyme inhibitor
 DG01522  CYP3A4 inhibitor
Remark
Therapeutic category: 6250
ATC code: J05AE07
Chemical structure group: DG00656
Product (DG00656): D02867<JP> D03835<US>
Efficacy
Antiviral, HIV protease inhibitor
Comment
Active form of prodrug: Amprenavir [DR:D00894]
Target
HIV protease [KO:K22599]
Metabolism
Enzyme: CYP3A4 [HSA:1576]
Interaction
CYP inhibition: CYP3A4 [HSA:1576]
Structure map
map07053  Anti-HIV agents
map07218  HIV protease inhibitors
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J05 ANTIVIRALS FOR SYSTEMIC USE
   J05A DIRECT ACTING ANTIVIRALS
    J05AE Protease inhibitors
     J05AE07 Fosamprenavir
      D02867  Fosamprenavir calcium hydrate (JAN) <JP>
USP drug classification [BR:br08302]
 Antivirals
  Anti-HIV Agents, Protease Inhibitors (PI)
   Fosamprenavir
    D02867  Fosamprenavir calcium hydrate (JAN)
Therapeutic category of drugs in Japan [BR:br08301]
 6  Agents against pathologic organisms and parasites
  62  Chemotherapeutics
   625  Antivirals
    6250  Antivirals
     D02867  Fosamprenavir calcium hydrate (JAN)
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D02867
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D02867
Prodrugs [br08324.html]
 DG00656
Other DBs
PubChem: 17397024
LigandBox: D02867
KCF data

ATOM        41
            1   O0  O    23.4177  -18.9171
            2   Z   Ca    7.9800  -25.9700 #2+
            3   N1c N    16.1000  -22.0500
            4   C1b C    14.9800  -21.3500
            5   S4a S    17.6400  -21.3500
            6   C1c C    13.7900  -22.0500
            7   C8y C    19.0400  -22.0500
            8   C1c C    12.6000  -21.3500
            9   N1b N    11.4800  -22.0500
            10  C7a C    10.2900  -21.3500
            11  O7a O     9.1000  -22.0500
            12  O6a O    10.2900  -20.0200
            13  C1y C     7.9100  -21.4200
            14  C8x C    19.0400  -23.4500
            15  C8x C    20.2300  -24.0800
            16  C8y C    21.3500  -23.4500
            17  C8x C    21.3500  -22.0500
            18  C8x C    20.2300  -21.3500
            19  N1a N    22.6100  -24.1500
            20  O2b O    13.7900  -24.0800
            21  P1b P    12.6000  -24.8500
            22  O1c O    11.0600  -25.6200 #-
            23  O3c O    16.6600  -20.4400
            24  O3c O    18.5500  -20.4400
            25  O1c O    13.3000  -26.0400 #-
            26  O1c O    11.9000  -23.6600
            27  C1x C     7.9100  -20.0900
            28  C1x C     6.6500  -21.8400
            29  C1x C     5.8100  -20.7900
            30  O2x O     6.6500  -19.6700
            31  C1b C    16.1000  -23.4500
            32  C1c C    17.2900  -24.2200
            33  C1a C    18.5500  -23.5200
            34  C1a C    17.2900  -25.5500
            35  C1b C    12.6000  -19.9500
            36  C8y C    13.7900  -19.2500
            37  C8x C    15.0500  -19.9500
            38  C8x C    16.2400  -19.1800
            39  C8x C    16.2400  -17.7800
            40  C8x C    14.9800  -17.0800
            41  C8x C    13.7900  -17.8500
BOND        41
            1     3   4 1
            2     3   5 1
            3     4   6 1
            4     5   7 1
            5     6   8 1
            6     8   9 1
            7     9  10 1
            8    10  11 1
            9    10  12 2
            10   13  11 1 #Up
            11    7  14 2
            12   14  15 1
            13   15  16 2
            14   16  17 1
            15   17  18 2
            16    7  18 1
            17   16  19 1
            18    6  20 1 #Up
            19   20  21 1
            20   21  22 1
            21    5  23 2
            22    5  24 2
            23   21  25 1
            24   21  26 2
            25   13  27 1
            26   13  28 1
            27   28  29 1
            28   29  30 1
            29   27  30 1
            30    3  31 1
            31   31  32 1
            32   32  33 1
            33   32  34 1
            34    8  35 1 #Up
            35   35  36 1
            36   36  37 2
            37   37  38 1
            38   38  39 2
            39   39  40 1
            40   40  41 2
            41   36  41 1
BRACKET     1    21.2800  -19.8800   21.2800  -17.7800
            1    24.2200  -17.7800   24.2200  -19.8800
            1  x
 ORIGINAL  1    1
 REPEAT    1

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