KEGG   DRUG: AmprenavirHelp
Entry
D00894                      Drug                                   

Name
Amprenavir (JAN/USAN/INN);
Agenerase (TN)
Formula
C25H35N3O6S
Exact mass
505.2247
Mol weight
505.6269
Structure
Mol fileKCF fileDB searchJmolKegDraw
Class
Antiviral
 DG01647  HIV protease inhibitor
Cyp substrate
 DG01633  CYP3A substrate
Cyp inhibitor
 DG01522  CYP3A4 inhibitor
Cyp inducer
 DG01635  CYP3A4 inducer
 DG01897  CYP3A5 inducer
Remark
Same as: 
ATC code: 
Activity
Antiviral, HIV protease inhibitor
Target
HIV protease [CPD:C19849]
Metabolism
Enzyme: CYP3A4 [HSA:1576]
Interaction
CYP inhibition: CYP3A [HSA:1576 1577 1551]
CYP induction: CYP3A [HSA:1576 1577 1551]
Drug interaction
Structure map
Anti-HIV agents
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
     J05AE05 Amprenavir
      D00894  Amprenavir (JAN/USAN/INN)
Antiinfectives [BR:br08307]
 Antivirals
  Anti-HIV agents
   Protease inhibitor (PIs)
    Nonpeptidic
     Amprenavir
      D00894  Amprenavir (JAN/USAN/INN)
Cytochrome P450 interactions [BR:br08309]
 CYP inhbitors
  CYP3A
   Amprenavir
    D00894  Amprenavir (JAN/USAN/INN)
 CYP inducers
  CYP3A
   Amprenavir
    D00894  Amprenavir (JAN/USAN/INN)
 CYP substrates
  CYP3A4
   Amprenavir
    D00894  Amprenavir (JAN/USAN/INN)
New drug approvals in the USA [br08319.html]
 New Molecular Entity and New Therapeutic Biological Product Approvals
  D00894
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D00894
BRITE hierarchy
Other DBs
CAS: 
161814-49-9
PubChem: 
DrugBank: 
PDB-CCD: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        35
            1   C8y C    23.0025  -16.3081
            2   C8x C    23.0025  -17.6809
            3   C8x C    24.1913  -18.3672
            4   C8y C    25.3802  -17.6809
            5   C8x C    25.3802  -16.3081
            6   C8x C    24.1913  -15.6218
            7   S4a S    21.8137  -15.6218
            8   N1a N    26.5873  -18.3780
            9   N1c N    20.6415  -16.2987
            10  C1b C    19.4773  -15.6266
            11  C1c C    18.3093  -16.3012
            12  C1c C    17.1430  -15.6279
            13  N1b N    15.9761  -16.3018
            14  O3c O    22.7844  -14.6512
            15  O3c O    20.8430  -14.6512
            16  O1a O    18.3093  -17.6806
            17  C7a C    14.8092  -15.6282
            18  O7a O    13.6425  -16.3020
            19  O6a O    14.8090  -14.2493
            20  C1y C    12.4806  -15.6222
            21  C1x C    12.4656  -14.2356
            22  O2x O    11.1534  -13.8207
            23  C1x C    10.3533  -14.9405
            24  C1x C    11.1711  -16.0474
            25  C1b C    17.1428  -14.2493
            26  C8y C    18.3508  -13.5515
            27  C8x C    19.5328  -14.2338
            28  C8x C    20.7215  -13.5472
            29  C8x C    20.7213  -12.1745
            30  C8x C    19.5392  -11.4922
            31  C8x C    18.3505  -12.1788
            32  C1b C    20.6416  -18.2700
            33  C1c C    21.8603  -19.1136
            34  C1a C    23.0590  -18.4214
            35  C1a C    21.8604  -20.5099
BOND        37
            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     1   7 1
            8     4   8 1
            9     7   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14    7  14 2
            15    7  15 2
            16   11  16 1 #Up
            17   13  17 1
            18   17  18 1
            19   17  19 2
            20   20  18 1 #Up
            21   20  21 1
            22   21  22 1
            23   22  23 1
            24   23  24 1
            25   20  24 1
            26   12  25 1 #Up
            27   25  26 1
            28   26  27 2
            29   27  28 1
            30   28  29 2
            31   29  30 1
            32   30  31 2
            33   26  31 1
            34    9  32 1
            35   32  33 1
            36   33  34 1
            37   33  35 1

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