Drug Information

Drug General Information
Drug ID
D0D2VS
Former ID
DAP000625
Drug Name
Exemestane
Synonyms
Aromasil; Aromasin; Aromasine; EXE; Exemestance; Exemestano; Exemestanum; Nikidess; Pfizer brand of exemestane; Curator_000009; Fce 24304; Aromasin (TN); Aromasin, Exemestane; Exemestano [INN-Spanish]; Exemestanum [INN-Latin]; FCE-24304; PNU-155971; Exemestane [USAN:INN:BAN]; Exemestane (JAN/USP/INN); (8R,9S,10R,13S,14S)-10,13-dimethyl-6-methylidene-7,8,9,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-3,17-dione; 6-Methylenandrosta-1,4-diene-3,17-dione; 6-Methyleneandrosta-1,4-diene-3,17-dione; 6-methylideneandrosta-1,4-diene-3,17-dione
Drug Type
Small molecular drug
Indication Hormonally-responsive breast cancer [ICD9: 174, 175; ICD10:C50] Approved [536361], [542079]
Therapeutic Class
Anticancer Agents
Structure
Download
2D MOL

3D MOL
Formula
C20H24O2
InChI
InChI=1S/C20H24O2/c1-12-10-14-15-4-5-18(22)20(15,3)9-7-16(14)19(2)8-6-13(21)11-17(12)19/h6,8,11,14-16H,1,4-5,7,9-10H2,2-3H3/t14-,15-,16-,19+,20-/m0/s1
InChIKey
BFYIZQONLCFLEV-DAELLWKTSA-N
CAS Number
CAS 107868-30-4
PubChem Compound ID
60198
PubChem Substance ID
10362, 532118, 7848026, 7978495, 8186720, 11528610, 12014009, 14898201, 14922734, 26719821, 43117629, 46386592, 46508243, 47734117, 48415996, 49681613, 53787997, 57313998, 71825450, 76229105, 92308414, 92712532, 99436932, 99437373, 103770357, 104320132, 117585772, 118043418, 119525530, 124658984, 124757072, 125163876, 126608810, 126630089, 126666059, 127510064, 134337915, 135260226, 135724569, 136367947, 136903807, 136946607, 137005560, 137230761, 141857635, 144115969, 144205052, 151979532, 152034580, 152164568
SuperDrug ATC ID
L02BG06
SuperDrug CAS ID
cas=107868304
Target and Pathway
Target(s) Cytochrome P450 19 Target Info Inhibitor [535836]
BioCyc Pathway Superpathway of steroid hormone biosynthesis
Estradiol biosynthesis II
Estradiol biosynthesis I
KEGG Pathway Steroid hormone biosynthesis
Metabolic pathways
Ovarian steroidogenesis
NetPath Pathway FSH Signaling Pathway
PANTHER Pathway Androgen/estrogene/progesterone biosynthesis
PathWhiz Pathway Androgen and Estrogen Metabolism
Reactome Endogenous sterols
WikiPathways Metapathway biotransformation
Tryptophan metabolism
Oxidation by Cytochrome P450
Ovarian Infertility Genes
Metabolism of steroid hormones and vitamin D
FSH signaling pathway
Integrated Breast Cancer Pathway
Phase 1 - Functionalization of compounds
References
Ref 536361Natural products as sources of new drugs over the last 25 years. J Nat Prod. 2007 Mar;70(3):461-77. Epub 2007 Feb 20.
Ref 542079(http://www.guidetopharmacology.org/) Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 7073).
Ref 535836Aromatase inhibitors--theoretical concept and present experiences in the treatment of endometriosis. Zentralbl Gynakol. 2003 Jul-Aug;125(7-8):247-51.

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