Development of a cheminformatics platform for selectivity analyses of carbonic anhydrase inhibitors

Development of a cheminformatics platform for selectivity analyses of carbonic anhydrase inhibitors

The selectivity for a specific human Carbonic Anhydrase (hCA) isoform is an important property a hCA inhibitor (CAI) should be endowed with, in order to constitute a valuable therapeutic tool for the treatment of a desired pathology. In this context, we developed a chemoinformatic platform that allo...

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Bibliographic Details
Main Authors: Giulio Poli, Salvatore Galati, Adriano Martinelli, Claudiu T. Supuran, Tiziano Tuccinardi
Format: Article
Language:English
Published: Taylor & Francis Group 2020-01-01
Series:Journal of Enzyme Inhibition and Medicinal Chemistry
Subjects:
carbonic anhydrase
fingerprint
clustering
selectivity
Online Access:http://dx.doi.org/10.1080/14756366.2019.1705291

Internet

http://dx.doi.org/10.1080/14756366.2019.1705291

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