Use of 3D QSAR Pharmacophore Modelling in the Research of Influenza
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F00216305%3A26220%2F16%3APU119067" target="_blank" >RIV/00216305:26220/16:PU119067 - isvavai.cz</a>
Result on the web
<a href="https://apps.webofknowledge.com/full_record.do?product=WOS&search_mode=GeneralSearch&qid=73&SID=E65zV7LctMFnjzQCxim&page=1&doc=1" target="_blank" >https://apps.webofknowledge.com/full_record.do?product=WOS&search_mode=GeneralSearch&qid=73&SID=E65zV7LctMFnjzQCxim&page=1&doc=1</a>
DOI - Digital Object Identifier
—
Alternative languages
Result language
angličtina
Original language name
Use of 3D QSAR Pharmacophore Modelling in the Research of Influenza
Original language description
Influenza is a grave infectious disease, which is life-threatening especially in children, golden ager and immunocompromised patients. In addition to immunization, the development of new anti-influenza agents epitomizes a crucial defence stratagem to combat periodic and pandemic influenza strains. At present most consideration is waged to the advance of inhibitors of influenza neuraminidase, which has been recognized as a key drug target for the prophylaxis and treatment of influenza infections. However, the advent of drug-resistant influenza variants highlights the need of unceasingly innovative strategies for the development of new drugs with value-added antiviral effects, higher safety and increased tolerability. A pharmacophore is a set of structural features in a ligand that are directly related to the ligand's recognition at a receptor site and its biological activity. In the current work, 3D pharmacophore based mapping is performed for Influenza A neuraminidase complexed with zanamivir, oseltamivir and peramivir drugs. The study focusses to identify the important pharmacophoric features present in the active site responsible for hydrogen bonding with the drugs. The study will be extended to study the mutational aspects in the protein with respect to the change in the pharmacophore features that is responsible for multi-drug resistance.
Czech name
—
Czech description
—
Classification
Type
D - Article in proceedings
CEP classification
—
OECD FORD branch
10608 - Biochemistry and molecular biology
Result continuities
Project
—
Continuities
S - Specificky vyzkum na vysokych skolach
Others
Publication year
2016
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Article name in the collection
4th International Conference on Chemical Technology
ISBN
978-80-86238-91-3
ISSN
—
e-ISSN
—
Number of pages
5
Pages from-to
529-533
Publisher name
Neuveden
Place of publication
neuveden
Event location
Mikulov
Event date
Apr 25, 2016
Type of event by nationality
EUR - Evropská akce
UT code for WoS article
000579333500095