A Prospective Virtual Screening Study: Enriching Hit Rates and Designing Focus Libraries To Find Inhibitors of PI3Kδ and PI3Kγ
Author:
Affiliation:
1. Discovery Sciences and ‡Immunology, Janssen Research & Development, San Diego, California 92121, United States
Publisher
American Chemical Society (ACS)
Subject
Drug Discovery,Molecular Medicine
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jmedchem.5b01974
Reference28 articles.
1. Comprehensive Mechanistic Analysis of Hits from High-Throughput and Docking Screens against β-Lactamase
2. Increasing Chemical Space Coverage by Combining Empirical and Computational Fragment Screens
3. Virtual and biomolecular screening converge on a selective agonist for GPR30
4. Here Be Dragons: Docking and Screening in an Uncharted Region of Chemical Space
5. Complementarity between in Silico and Biophysical Screening Approaches in Fragment-Based Lead Discovery against the A2A Adenosine Receptor
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