Search Results - "Poehner, Ina"
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Structure and dynamics of pteridine reductase 1: the key phenomena relevant to enzyme function and drug design
Published in European biophysics journal (01-10-2023)“…Pteridine reductase 1 (PTR1) is a folate and pterin pathway enzyme unique for pathogenic trypanosomatids. As a validated drug target, PTR1 has been the focus…”
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MCMapA Computational Tool for Mapping Energy Landscapes of Transient Protein–Protein Interactions
Published in ACS omega (30-06-2018)“…MCMap is a tool particularly well-suited for analyzing energy landscapes of transient macromolecular complexes. The program applies a Monte Carlo strategy,…”
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Global profiling of SRP interaction with nascent polypeptides
Published in Nature (London) (11-08-2016)“…Here, the selection of substrates by the protein–RNA complex known as the signal recognition particle (SRP) is investigated in the bacterium Escherichia coli ,…”
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Multitarget, Selective Compound Design Yields Potent Inhibitors of a Kinetoplastid Pteridine Reductase 1
Published in Journal of medicinal chemistry (14-07-2022)“…The optimization of compounds with multiple targets is a difficult multidimensional problem in the drug discovery cycle. Here, we present a systematic,…”
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The trypanocidal benzoxaborole AN7973 inhibits trypanosome mRNA processing
Published in PLoS pathogens (25-09-2018)“…Kinetoplastid parasites-trypanosomes and leishmanias-infect millions of humans and cause economically devastating diseases of livestock, and the few existing…”
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Comparative mapping of on-targets and off-targets for the discovery of anti-trypanosomatid folate pathway inhibitors
Published in Biochimica et biophysica acta. General subjects (01-12-2017)“…[Display omitted] Multi-target approaches are necessary to properly analyze or modify the function of a biochemical pathway or a protein family. An example of…”
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Chroman-4-One Derivatives Targeting Pteridine Reductase 1 and Showing Anti-Parasitic Activity
Published in Molecules (Basel, Switzerland) (08-03-2017)“…Flavonoids have previously been identified as antiparasitic agents and pteridine reductase 1 (PTR1) inhibitors. Herein, we focus our attention on the…”
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MatchTope: A tool to predict the cross reactivity of peptides complexed with Major Histocompatibility Complex I
Published in Frontiers in immunology (28-10-2022)“…The therapeutic targeting of the immune system, for example in vaccinology and cancer treatment, is a challenging task and the subject of active research…”
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Profiling of Flavonol Derivatives for the Development of Antitrypanosomatidic Drugs
Published in Journal of medicinal chemistry (25-08-2016)“…Flavonoids represent a potential source of new antitrypanosomatidic leads. Starting from a library of natural products, we combined target-based screening on…”
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Accelerating Drug Discovery Efforts for Trypanosomatidic Infections Using an Integrated Transnational Academic Drug Discovery Platform
Published in SLAS discovery (01-03-2019)“…According to the World Health Organization, more than 1 billion people are at risk of or are affected by neglected tropical diseases. Examples of such diseases…”
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Exploiting the 2‑Amino-1,3,4-thiadiazole Scaffold To Inhibit Trypanosoma brucei Pteridine Reductase in Support of Early-Stage Drug Discovery
Published in ACS omega (30-09-2017)“…Pteridine reductase-1 (PTR1) is a promising drug target for the treatment of trypanosomiasis. We investigated the potential of a previously identified class of…”
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