Sarah Naomi Bolz

TL;DR: PLIP as discussed by the authors is a profiler for protein-ligand interaction profilers that detects and visualises these interactions and provides data in formats suitable for further processing, including DNA and RNA.

TL;DR: This work systematically evaluated over 100 drugs, 200 target structures and over 300 indications from the Drug Repositioning Database and concluded that, despite the use of umbrella term “drug” repositioning, disease- and target-centric approaches have dominated the field until now.

TL;DR: In this article, the binding mode conservation of 34 PAINS classes was analyzed using the Protein Data Bank (PDB) to characterize the binding modes of PAINS-like compounds.

TL;DR: The data indicate that SLAMF receptors are important modulators of the BCR signaling axis and may improve immune control in CLL by interference with NK cells.

TL;DR: This work conducts a structure-based drug repositioning approach with over 130,000 3D protein structures to identify drugs that bind therapeutic Chagas targets and thus represent potential new ChagAs treatments, and shows that the approach is able to pinpoint relevant drug candidates at a fraction of the time and cost of a conventional screening.