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Discovery of 1,3,4-Oxadiazin-5-One Derivative CJ1-34 as a Partial ATP Synthase Inhibitor for CNS Applications Jie, Caitlin V. M. L.; Delparente, Aro; Reichert, Lisa; Albrecht, Manuela; Atz, Kenneth; Schneider, Gisbert; Schibli, Roger; Mu, Linjing Share Save
Prospective de novo drug design with deep interactome learning Atz, Kenneth; Cotos, Leandro; Isert, Clemens; Hakansson, Maria; Focht, Dorota; Hilleke, Mattis; Nippa, David F.; Iff, Michael; Ledergerber, Jann; Schiebroek, Carl C. G.; Romeo, Valentina; Hiss, Jan A.; Merk, Daniel; Schneider, Petra; Kuhn, Bernd; Grether, Uwe; Schneider, Gisbert Share Save
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Baricitinib and tofacitinib off-target profile, with a focus on Alzheimer's disease Faquetti, Maria L.; Slappendel, Laura; Bigonne, Helene; Grisoni, Francesca; Schneider, Petra; Aichinger, Georg; Schneider, Gisbert; Sturla, Shana J.; Burden, Andrea M. Share Save
Geometric deep learning-guided Suzuki reaction conditions assessment for applications in medicinal chemistry Atz, Kenneth; Nippa, David F.; Mueller, Alex T.; Jost, Vera; Anelli, Andrea; Reutlinger, Michael; Kramer, Christian; Martin, Rainer E.; Grether, Uwe; Schneider, Gisbert; Wuitschik, Georg Share Save
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Identifying opportunities for late-stage C-H alkylation with high-throughput experimentation and in silico reaction screening Nippa, David F.; Atz, Kenneth; Mueller, Alex T.; Wolfard, Jens; Isert, Clemens; Binder, Martin; Scheidegger, Oliver; Konrad, David B.; Grether, Uwe; Martin, Rainer E.; Schneider, Gisbert Share Save
Allosteric targeting resolves limitations of earlier LFA-1 directed modalities Mancuso, Riccardo V.; Schneider, Gisbert; Hurzeler, Marianne; Gut, Martin; Zurfluh, Jonas; Breitenstein, Werner; Bouitbir, Jamal; Reisen, Felix; Atz, Kenneth; Ehrhardt, Claus; Duthaler, Urs; Gygax, Daniel; Schmidt, Albrecht G.; Krahenbuhl, Stephan; Weitz-Schmidt, Gabriele Share Save
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Discovery of a small molecule ligand of FRS2 that inhibits invasion and tumor growth Kumar, Karthiga Santhana; Brunner, Cyrill; Schuster, Matthias; Kopp, Levi Luca; Gries, Alexandre; Yan, Shen; Jurt, Simon; Moehle, Kerstin; Bruns, Dominique; Grotzer, Michael; Zerbe, Oliver; Schneider, Gisbert; Baumgartner, Martin Share Save
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Computer-Aided Design and Synthesis of a New Class of PEX14 Inhibitors: Substituted 2,3,4,5-Tetrahydrobenzo[F][1,4]oxazepines as Potential New Trypanocidal Agents Fino, Roberto; Lenhart, Dominik; Kalel, Vishal C.; Softley, Charlotte A.; Napolitano, Valeria; Byrne, Ryan; Schliebs, Wolfgang; Dawidowski, Maciej; Erdmann, Ralf; Sattler, Michael; Schneider, Gisbert; Plettenburg, Oliver; Popowicz, Grzegorz M. Share Save
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