Artificial Intelligence-Based Computational Screening and Functional Assays Identify Candidate Small Molecule Antagonists of PTPmu-Dependent Adhesion

por Molyneaux, Kathleen, Laggner, Christian, Brady-Kalnay, Susann M.
Publicado 2023

A novel binding pocket in the D2 domain of protein tyrosine phosphatase mu (PTPmu) guides AI screen to identify small molecules that modulate tumour cell adhesion, growth and migra...

por Molyneaux, Kathleen, Laggner, Christian, Brady‐Kalnay, Susann M.
Publicado 2023

Small molecule antagonists of PTPmu identified by artificial intelligence-based computational screening block glioma cell migration and growth

por Molyneaux, Kathleen, Laggner, Christian, Vincent, Jason, Brady-Kalnay, Susann
Publicado 2023

Quantifying Biogenic Bias in Screening Libraries

por Hert, Jérôme, Irwin, John J., Laggner, Christian, Keiser, Michael J., Shoichet, Brian K.
Publicado 2009

AtomNet-Aided OTUD7B Inhibitor Discovery and Validation

por Chen, Jianfeng, Bolhuis, Derek L., Laggner, Christian, Kong, Deyu, Yu, Le, Wang, Xiaodong, Emanuele, Michael J., Brown, Nicholas G., Liu, Pengda
Publicado 2023

In Silico Molecular Comparisons of C. elegans and Mammalian Pharmacology Identify Distinct Targets That Regulate Feeding

por Lemieux, George A., Keiser, Michael J., Sassano, Maria F., Laggner, Christian, Mayer, Fahima, Bainton, Roland J., Werb, Zena, Roth, Bryan L., Shoichet, Brian K., Ashrafi, Kaveh
Publicado 2013

Chemical Informatics and Target Identification in a Zebrafish Phenotypic Screen

por Laggner, Christian, Kokel, David, Setola, Vincent, Tolia, Alexandra, Lin, Henry, Irwin, John J., Keiser, Michael J., Cheung, Chung Yan J., Minor, Daniel L., Roth, Bryan L., Peterson, Randall T., Shoichet, Brian K.
Publicado 2011

Rapid behavior—based identification of neuroactive small molecules in the zebrafish

por Kokel, David, Bryan, Jennifer, Laggner, Christian, White, Rick, Cheung, Chung Yan J., Mateus, Rita, Healey, David, Kim, Sonia, Werdich, Andreas A., Haggarty, Stephen J., MacRae, Calum A., Shoichet, Brian, Peterson, Randall T.
Publicado 2010

SPOP and OTUD7A Control EWS–FLI1 Protein Stability to Govern Ewing Sarcoma Growth

por Su, Siyuan, Chen, Jianfeng, Jiang, Yao, Wang, Ying, Vital, Tamara, Zhang, Jiaming, Laggner, Christian, Nguyen, Kong T., Zhu, Zhichuan, Prevatte, Alex W., Barker, Natalie K., Herring, Laura E., Davis, Ian J., Liu, Pengda
Publicado 2021

Predicting new molecular targets for known drugs

por Keiser, Michael J., Setola, Vincent, Irwin, John J., Laggner, Christian, Abbas, Atheir, Hufeisen, Sandra J., Jensen, Niels H., Kuijer, Michael B., Matos, Roberto C., Tran, Thuy B., Whaley, Ryan, Glennon, Richard A., Hert, Jérôme, Thomas, Kelan L.H., Edwards, Douglas D., Shoichet, Brian K., Roth, Bryan L.
Publicado 2009