Quadruple Target Evaluation of Diversity-Optimized Halogen-Enriched Fragments (HEFLibs) Reveals Substantial Ligand Efficiency for AP2-Associated Protein Kinase 1 (AAK1)
Dammann, Marcel, Kramer, Markus, Zimmermann, Markus O, Boeckler, Frank M
Published in Frontiers in chemistry (02.02.2022)
Published in Frontiers in chemistry (02.02.2022)
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Journal Article
Discovery of Ircinianin Lactones B and C—Two New Cyclic Sesterterpenes from the Marine Sponge Ircinia wistarii
Majer, Thomas, Bhattarai, Keshab, Straetener, Jan, Pohlmann, Justus, Cahill, Patrick, Zimmermann, Markus O., Hübner, Marc P., Kaiser, Marcel, Svenson, Johan, Schindler, Michael, Brötz-Oesterhelt, Heike, Boeckler, Frank M., Gross, Harald
Published in Marine drugs (19.08.2022)
Published in Marine drugs (19.08.2022)
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Journal Article
Screening of a Halogen-Enriched Fragment Library Leads to Unconventional Binding Modes
Dammann, Marcel, Stahlecker, Jason, Zimmermann, Markus O., Klett, Theresa, Rotzinger, Kilian, Kramer, Markus, Coles, Murray, Stehle, Thilo, Boeckler, Frank M.
Published in Journal of medicinal chemistry (10.11.2022)
Published in Journal of medicinal chemistry (10.11.2022)
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Journal Article
Halogen-Enriched Fragment Libraries as Leads for Drug Rescue of Mutant p53
Wilcken, Rainer, Liu, Xiangrui, Zimmermann, Markus O., Rutherford, Trevor J., Fersht, Alan R., Joerger, Andreas C., Boeckler, Frank M.
Published in Journal of the American Chemical Society (18.04.2012)
Published in Journal of the American Chemical Society (18.04.2012)
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Journal Article
Principles and Applications of CF2X Moieties as Unconventional Halogen Bond Donors in Medicinal Chemistry, Chemical Biology, and Drug Discovery
Vaas, Sebastian, Zimmermann, Markus O., Schollmeyer, Dieter, Stahlecker, Jason, Engelhardt, Marc U., Rheinganz, Janosch, Drotleff, Bernhard, Olfert, Matthias, Lämmerhofer, Michael, Kramer, Markus, Stehle, Thilo, Boeckler, Frank M.
Published in Journal of medicinal chemistry (10.08.2023)
Published in Journal of medicinal chemistry (10.08.2023)
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Journal Article
Halogen Bonding on Water─A Drop in the Ocean?
Engelhardt, Marc U., Zimmermann, Markus O., Dammann, Marcel, Stahlecker, Jason, Poso, Antti, Kronenberger, Thales, Kunick, Conrad, Stehle, Thilo, Boeckler, Frank M.
Published in Journal of chemical theory and computation (18.09.2024)
Published in Journal of chemical theory and computation (18.09.2024)
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Journal Article
Scaffold Effects on Halogen Bonding Strength
Lange, Andreas, Heidrich, Johannes, Zimmermann, Markus O, Exner, Thomas E, Boeckler, Frank M
Published in Journal of chemical information and modeling (25.02.2019)
Published in Journal of chemical information and modeling (25.02.2019)
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Journal Article
Principles and Applications of CF 2 X Moieties as Unconventional Halogen Bond Donors in Medicinal Chemistry, Chemical Biology, and Drug Discovery
Vaas, Sebastian, Zimmermann, Markus O, Schollmeyer, Dieter, Stahlecker, Jason, Engelhardt, Marc U, Rheinganz, Janosch, Drotleff, Bernhard, Olfert, Matthias, Lämmerhofer, Michael, Kramer, Markus, Stehle, Thilo, Boeckler, Frank M
Published in Journal of medicinal chemistry (10.08.2023)
Published in Journal of medicinal chemistry (10.08.2023)
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Journal Article
Targeting the Gatekeeper MET146 of C‑Jun N‑Terminal Kinase 3 Induces a Bivalent Halogen/Chalcogen Bond
Lange, Andreas, Günther, Marcel, Büttner, Felix Michael, Zimmermann, Markus O, Heidrich, Johannes, Hennig, Susanne, Zahn, Stefan, Schall, Christoph, Sievers-Engler, Adrian, Ansideri, Francesco, Koch, Pierre, Laemmerhofer, Michael, Stehle, Thilo, Laufer, Stefan A, Boeckler, Frank M
Published in Journal of the American Chemical Society (25.11.2015)
Published in Journal of the American Chemical Society (25.11.2015)
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Journal Article
Using Surface Scans for the Evaluation of Halogen Bonds toward the Side Chains of Aspartate, Asparagine, Glutamate, and Glutamine
Zimmermann, Markus O, Lange, Andreas, Zahn, Stefan, Exner, Thomas E, Boeckler, Frank M
Published in Journal of chemical information and modeling (25.07.2016)
Published in Journal of chemical information and modeling (25.07.2016)
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Journal Article
Revisiting a challenging p53 binding site: a diversity-optimized HEFLib reveals diverse binding modes in T-p53C-Y220C
Stahlecker, Jason, Klett, Theresa, Schwer, Martin, Jaag, Simon, Dammann, Marcel, Ernst, Larissa N, Braun, Michael B, Zimmermann, Markus O, Kramer, Markus, Lämmerhofer, Michael, Stehle, Thilo, Coles, Murray, Boeckler, Frank M
Published in MedChemComm (14.12.2022)
Published in MedChemComm (14.12.2022)
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Journal Article
Tri- and Tetrasubstituted Pyrazole Derivates: Regioisomerism Switches Activity from p38MAP Kinase to Important Cancer Kinases
Thaher, Bassam Abu, Arnsmann, Martina, Totzke, Frank, Ehlert, Jan E, Kubbutat, Michael H. G, Schächtele, Christoph, Zimmermann, Markus O, Koch, Pierre, Boeckler, Frank M, Laufer, Stefan A
Published in Journal of medicinal chemistry (26.01.2012)
Published in Journal of medicinal chemistry (26.01.2012)
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Journal Article
Halogen-enriched fragment libraries as chemical probes for harnessing halogen bonding in fragment-based lead discovery
Zimmermann, Markus O, Lange, Andreas, Wilcken, Rainer, Cieslik, Markus B, Exner, Thomas E, Joerger, Andreas C, Koch, Pierre, Boeckler, Frank M
Published in Future medicinal chemistry (01.04.2014)
Published in Future medicinal chemistry (01.04.2014)
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Journal Article
Intramolecular signaling in tandem-GAF domains from PDE5 and PDE10 studied with a cyanobacterial adenylyl cyclase reporter
Banjac, Ana, Zimmermann, Markus O., Boeckler, Frank M., Kurz, Ursula, Schultz, Anita, Schultz, Joachim E.
Published in Cellular signalling (01.03.2012)
Published in Cellular signalling (01.03.2012)
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Journal Article