Group of Prof. Daniel Merk - Faculty for Chemistry and Pharmacy
Group of Prof. Daniel Merk - Faculty for Chemistry and Pharmacy
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Department für Pharmazie Zi.Nr.: C1.061  |
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"Anwendung und Entwicklung von moleküldynamischen Rechenverfahren zur Strukturbestimmung von biologisch aktiven Peptiden und Proteinen" (TU München, 1992, Prof. Dr. H. Kessler)
Sai, M.; Vietor, J.; Kornmayer, M.; Egner, M.; López-García, U.; Höfner, G.; Pabel, J.; Marschner, J.; Wein, T.; Merk, D. Structure-Guided Design of Nurr1 Agonists Derived from the Natural Ligand Dihydroxyindole. J. Med. Chem., 2023, DOI
Silvia Arifi, Daniel Zaienne, Jan Heering, Thomas Wein, Rezart Zhubi, Apirat Chaikuad, Stefan Knapp, Julian A. Marschner, und Daniel Merk. „Fragment-Based Discovery of Orphan Nuclear Receptor Nur77/NGFI-B Ligands“. Bioorganic Chemistry 129 (1. Dezember 2022): 106164. https://doi.org/10.1016/j.bioorg.2022.106164.
Li Gao, Yvonne Kraus, Andrea Stegner, Thomas Wein, Constanze Heise, Leonie von Brunn, Elena Fajardo-Ruiz, Julia Thorn-Seshold, und Oliver Thorn-Seshold. „Self-Reporting Styrylthiazolium Photopharmaceuticals: Mitochondrial Localisation as Well as SAR Drive Biological Activity“. Organic & Biomolecular Chemistry 20, Nr. 39 (12. Oktober 2022): 7787–94. https://doi.org/10.1039/D2OB00347C.
T. J. Hauke, T. Wein, G. Höfner, K.T. Wanner, Novel Allosteric Ligands of γ‑Aminobutyric Acid Transporter 1 (GAT1) by MS Based Screening of Pseudostatic Hydrazone Libraries, J. Med. Chem., 2018, 61, 10310–10332. DOI
S. Sichler, G. Höfner, S. Rappenglück, T. Wein, K. V. Niessen, T. Seeger, F. Worek, H. Thiermann, F. F. Paintner, K. T. Wanner, Development of MS Binding Assays targeting the binding site of MB327 at the nicotinic acetylcholine receptor, Toxicol. Lett., 2018, 293, 172-183. DOI
T. Wein, G. Höfner, S. Rappenglück, S. Sichler, K.V. Niessen, T. Seeger, F. Worek, H. Thiermann, K.T. Wanner, Searching for putative binding sites of the bispyridinium compound MB327 in the nicotinic acetylcholine receptor, Toxicol. Lett., 2018, 293, 184-189. DOI
K.V. Niessen, T. Seeger, S. Rappenglück, T. Wein, G. Höfner, K.T. Wanner, H. Thiermann, F. Worek: In vitro pharmacological characterization of the bispyridinium non-oxime compound MB327 and its 2- and 3-regioisomers, Toxicol. Lett. , 2018, 293, 190-197. DOI
T. Lutz, T. Wein, G. Höfner, K.T. Wanner, "Development of Highly Potent GAT1 Inhibitors: Synthesis of Nipecotic Acid Derivatives with N-Arylalkynyl Substituents", ChemMedChem 2017, 12, 362-371. DOI
Tim Hellenbrand, Georg Höffner, Thomas Wein, Klaus T. Wanner, "Synthesis of 4-substituted nipecotic acid derivatives and their evaluation as potential GABA uptake inhibitors", Bioorganic & Medicinal Chemistry, 2016, 24, 2071-2096.
Marilena Petrera, Thomas Wein, Lars Allmendinger, Miriam Sindelar, Jörg Pabel, Georg Höfner, Klaus T. Wanner, "Development of Highly Potent GAT1 Inhibitors: Synthesis of Nipecotic Acid Derivatives by Suzuki-Miyaura Cross-Coupling Reactions", ChemMedChem, 2016, 11, 519-538.
Thomas Wein, Marilena Petrera, Lars Allmendinger, Georg Höfner, Jörg Pabel, Klaus T. Wanner, "Different Binding Modes of Small and Large Binders of GAT1", ChemMedChem, 2016, 11, 509-518.
Stylianos Michalakis, Xiangang Zong, Elvir Becirovic, Verena Hammelmann, Thomas Wein, Klaus Wanner, and Martin Biel, "The glutamic acid-rich protein is a gating inhibitor of cyclic nucleotide-gated channels", J. Neurosci., 2011, 31, 133-141.
T. Wein, K. T. Wanner, "Generation of a 3D model for human GABA transporter hGAT-1 using molecular modeling and investigation of the binding of GABA", J. Mol. Model, 2010, 16, 155-161.
H. Kessler, D. F. Mierke, J. Saulitis, S. Seip, S. Steuernagel, T. Wein, M. Will, "The structure of Ro 09-0198 in different environments", Biopolymers, 1992, 32, 427-433.
H. Kessler, T. Wein, "Solution structure of phalloidin obtained by NMR spectroscopy in [D6]DMSO and molecular dynamics calculation in vacuo and in water", Liebigs Annalen der Chemie, 1991, 179-184.
H. Kessler, M. Köck, T. Wein, M. Gehrke, "Reinvestigation of the Conformation of Cyclosporin A in Chloroform", Helv. Chim. Acta, 1990, 73, 1818-1832.