QSAR Multi-Target in Drug Discovery: A Review

Title:QSAR Multi-Target in Drug Discovery: A Review

Volume: 10 Issue: 2

Author(s): Riccardo Zanni, María Galvez-Llompart, Jorge Galvez and Ramon García-Domenech

Affiliation:

Keywords: Anaerobic bacteria, molecular topology, multi-target QSAR.

Abstract: The main purpose of the present review is to summarize the most significant works up to date in the field of multi-target QSAR (mt-QSAR), in order to emphasize the importance that this technique has acquired over the last decade. Unlike traditional QSAR techniques, mt-QSAR permits to calculate the probability of activity of a given compound against different biological or pharmacological targets. In simple terms, a single equation for multiple outputs.

To emphasize more the importance of the mt-QSAR in the field of drug discovery, we also present a novel mt-QSAR model, made on purpose by our research group, for the prediction of the susceptibility of Gram + and Gram – anaerobic bacteria.

Cite this article as:

Zanni Riccardo, Galvez-Llompart María, Galvez Jorge and García-Domenech Ramon, QSAR Multi-Target in Drug Discovery: A Review, Current Computer-Aided Drug Design 2014; 10(2) . https://dx.doi.org/10.2174/157340991002140708105124