The Use of Stilbene Scaffold in Medicinal Chemistry and Multi- Target Drug Design

2016 ◽  
Vol 23 (23) ◽  
pp. 2439-2489 ◽  
Author(s):  
Elisa Giacomini ◽  
Sebastiano Rupiani ◽  
Laura Guidotti ◽  
Maurizio Recanatini ◽  
Marinella Roberti
Keyword(s):  
Drug Design ◽  
Medicinal Chemistry ◽  
Target Drug

Physics and Its Interfaces with Medicinal Chemistry and Drug Design

2013 ◽  
Vol 43 (4) ◽  
pp. 268-280 ◽  
Author(s):  
Ricardo N. Santos ◽  
Adriano D. Andricopulo
Keyword(s):  
Drug Design ◽  
Medicinal Chemistry

Molecular Modeling Techniques Applied to the Design of Multitarget Drugs: Methods and Applications

2021 ◽  
Vol 21 ◽  
Author(s):  
Larissa Henriques Evangelista Castro ◽  
Carlos Mauricio R. Sant'Anna
Keyword(s):  
Drug Design ◽  
Similar Efficacy ◽  
Learning Approaches ◽  
Resistance Development ◽  
Multifactorial Diseases ◽  
Target Drug ◽  
Single Target ◽  
Modeling Techniques ◽  
Computer Based ◽  
New Challenges

: Multifactorial diseases, such as cancer and diabetes present a challenge for the traditional “one-target, one disease” paradigm due to their complex pathogenic mechanisms. Although a combination of drugs can be used, a multitarget drug may be a better choice face of its efficacy, lower adverse effects and lower chance of resistance development. The computer-based design of these multitarget drugs can explore the same techniques used for single-target drug design, but the difficulties associated to the obtention of drugs that are capable of modulating two or more targets with similar efficacy impose new challenges, whose solutions involve the adaptation of known techniques and also to the development of new ones, including machine-learning approaches. In this review, some SBDD and LBDD techniques for the multitarget drug design are discussed, together with some cases where the application of such techniques led to effective multitarget ligands.

From in silico target prediction to multi-target drug design: Current databases, methods and applications

2011 ◽  
Vol 74 (12) ◽  
pp. 2554-2574 ◽  
Author(s):  
Alexios Koutsoukas ◽  
Benjamin Simms ◽  
Johannes Kirchmair ◽  
Peter J. Bond ◽  
Alan V. Whitmore ◽  
...  
Keyword(s):  
Drug Design ◽  
In Silico ◽  
Target Prediction ◽  
Target Drug

Using Computer-aided Drug Design and Medicinal Chemistry Strategies in the Fight Against Diabetes

2011 ◽  
Vol 28 (5) ◽  
pp. 787-796 ◽  
Author(s):  
Evandro P. Semighini ◽  
Jonathan A. Resende ◽  
Peterson de Andrade ◽  
Pedro A. B. Morais ◽  
Ivone Carvalho ◽  
...  
Keyword(s):  
Drug Design ◽  
Medicinal Chemistry ◽  
Computer Aided Drug Design ◽  
Computer Aided
Sign in / Sign up

Export Citation Format

Share Document