Utjecaj strukturnih značajki antitumorskih inhibitora histon deacetilaze

master's thesis

• Title (english): Effect of structural features of antitumor histone deacetylase inhibitors
• Author: Sandra Morić
• Mentor: Milena Jadrijević-Mladar Takač (mentor)
• Committee member: Milena Jadrijević-Mladar Takač (predsjednik povjerenstva)
• Committee member: Irena Žuntar (član povjerenstva)
• Committee member: Monika Barbarić (član povjerenstva)
• Granter: University of Zagreb; Faculty of Pharmacy and Biochemistry; (Department of medicinal chemistry); Zagreb
• Defense date and country: 2019-07-11, Croatia
• Scientific / art field, discipline and subdiscipline: BIOMEDICINE AND HEALTHCARE; Pharmacy; Pharmacy

Abstract

U okviru ovog diplomskog rada istražen je odnos fizičko-kemijskih svojstva i parametara
toksičnosti odabranih antitumorskih inhibitora (n=31) histon deacetilaza (HDACi) koji sadrže
hidroksamsku skupinu, te su provedene QSAR korelacijske studije korištenjem molekulskih
deskriptora i ADMET svojstava u svrhu procjene potencijalne toksičnosti i sigurne terapijske
primjene ovih inhibitora. Rezultati istraživanja su pokazali da se molekulski deskriptori i ADMET
svojstva mogu uspješno primijeniti u predviđanju potencijalnih toksičnih učinaka ispitivanih
HDAC inhibitora.

Abstract (english)

In the frame of this diploma work, the relationship between physico-chemical properties and
toxicity parameters of selected anti-tumor HDAC inhibitors (n = 31) that contain a hydroxamic
acid moiety were investigated and the QSAR correlation studies were performed using molecular
descriptors and ADMET properties to evaluate the potential toxicity and safety profile of the
therapeutic application of these inhibitors. The results of these studies revealed that the use of
molecular descriptors and ADMET parameters can be successfully applied in prediction of the
potential toxic effects of investigated HDACIs.

• Keywords: HDAC; HDACi; ADMET; sigurnosni profil; toksičnost; QSAR
• Keywords (english): HDAC; HDACi; ADMET PredictorTM; safety profile; toxicity; QSAR
• Language: croatian
• URN:NBN: urn:nbn:hr:163:834148
• Study programme: Title: Pharmacy; Study programme type: university; Study level: integrated undergraduate and graduate; Academic / professional title: magistar/magistra farmacije (magistar/magistra farmacije)
• Type of resource: Text
• File origin: Born digital
• Access conditions: Open access
• Created on: 2020-02-24 08:41:15