KEGG DRUG: Exemestane

DRUG: Exemestane

Entry

D00963                      Drug

Name

Exemestane (JAN/USP/INN);
Aromasin (TN)

Product

AROMASIN (Pharmacia & Upjohn Company LLC)

Generic

EXEMESTANE (Amneal Pharmaceuticals LLC), EXEMESTANE (Aurobindo Pharma Limited), EXEMESTANE (Breckenridge Pharmaceutical), EXEMESTANE (Bryant Ranch Prepack), EXEMESTANE (Cipla USA), EXEMESTANE (Eirgen Pharma), EXEMESTANE (Florida Pharmaceutical Products), EXEMESTANE (Greenstone LLC), EXEMESTANE (Hikma Pharmaceuticals USA), EXEMESTANE (Upsher-Smith Laboratories), EXEMESTANE (Zydus Lifesciences Limited), EXEMESTANE (Zydus Pharmaceuticals USA)

Formula

C20H24O2

Exact mass

296.1776

Mol weight

296.4034

Structure

Simcomp

Class

Antineoplastic
DG01596  Aromatase inhibitor
Metabolizing enzyme substrate
DG01633  CYP3A/CYP3A4 substrate
  DG02913  CYP3A4 substrate

Remark

Same as:

C08162

Therapeutic category:

4291

ATC code:

L02BG06

Product:

D00963<JP/US>

Efficacy

Antineoplastic, Estrogen biosynthesis inhibitor

Disease

Breast cancer, postmenopausal (ER-positive) [DS:H00031]

Comment

Aromatase inhibitor

Target

CYP19A1 (ARO) [HSA:1588] [KO:K07434]

Pathway

hsa00140

Steroid hormone biosynthesis

Metabolism

Enzyme: CYP3A4 [HSA:1576]

Interaction

Structure map

map07043

Antineoplastics - hormones

Other map

map01522

Endocrine resistance

Brite

Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L02 ENDOCRINE THERAPY
   L02B HORMONE ANTAGONISTS AND RELATED AGENTS
    L02BG Aromatase inhibitors
     L02BG06 Exemestane
      D00963  Exemestane (JAN/USP/INN) <JP/US>
USP drug classification [BR:br08302]
Antineoplastics
  Aromatase Inhibitors
   Exemestane
    D00963  Exemestane (JAN/USP/INN)
Therapeutic category of drugs in Japan [BR:br08301]
4  Agents affecting cellular function
  42  Antineoplastics
   429  Miscellaneous
    4291  Other Antitumors
     D00963  Exemestane (JAN/USP/INN)
Drug groups [BR:br08330]
Antineoplastic
  DG01596  Aromatase inhibitor
   D00963  Exemestane
Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG02913  CYP3A4 substrate
    D00963  Exemestane
Drug classes [BR:br08332]
Antineoplastic
  DG01596  Aromatase inhibitor
   D00963  Exemestane
Target-based classification of drugs [BR:br08310]
Enzymes
  Oxidoreductases (EC1)
   Cytochrome P450
    CYP19A1 (ARO)
     D00963  Exemestane (JAN/USP/INN) <JP/US>
New drug approvals in the USA [br08319.html]
New molecular entities and new therapeutic biological products
  D00963
New drug approvals in Japan [br08318.html]
Drugs with new active ingredients
  D00963
New drug approvals in the USA, Europe and Japan [br08328.html]
Approval dates by FDA, EMA and PMDA
  D00963
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
  D00963
Pharmacogenomic biomarkers [br08341.html]
Somatic variations in targeted cancer therapies
  D00963

Other DBs

CAS:	107868-30-4

PubChem:

7848026

ChEBI:

4953

PDB-CCD:

EXM[PDBj]

LigandBox:

D00963

NIKKAJI:

J367.471A

KCF data

ATOM        22
            1   C2x C    12.2500  -16.2400
            2   C5x C    12.2500  -17.6400
            3   C2x C    13.4624  -18.3400
            4   C2y C    14.6749  -17.6400
            5   C1z C    14.6749  -16.2400
            6   C2x C    13.4624  -15.5400
            7   C2y C    15.8873  -18.3400
            8   C1x C    17.0997  -17.6400
            9   C1y C    17.0997  -16.2400
            10  C1y C    15.8873  -15.5400
            11  C1y C    18.3122  -15.5400
            12  C1z C    18.3122  -14.1400
            13  C1x C    17.0997  -13.4400
            14  C1x C    15.8873  -14.1400
            15  C1x C    20.7370  -15.5400
            16  C1x C    20.7370  -14.1400
            17  C5x C    19.5246  -13.4400
            18  O5x O    19.5246  -12.0400
            19  O5x O    11.0376  -18.3400
            20  C2a C    15.8873  -19.7400
            21  C1a C    14.6749  -14.8400
            22  C1a C    18.3122  -12.7400
BOND        25
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     1   6 2
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    9  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   10  14 1
            17   11  15 1
            18   15  16 1
            19   16  17 1
            20   12  17 1
            21   17  18 2
            22    2  19 2
            23    7  20 2
            24    5  21 1 #Up
            25   12  22 1 #Up

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