Search Results - "VENHORST, Jennifer"
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Battling Enteropathogenic Clostridia: Phage Therapy for Clostridioides difficile and Clostridium perfringens
Published in Frontiers in microbiology (13-06-2022)“…The pathogenic Clostridioides difficile and Clostridium perfringens are responsible for many health care-associated infections as well as systemic and enteric…”
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Oncostatin M: Risks and Benefits of a Novel Therapeutic Target for Atherosclerosis
Published in Current drug targets (01-01-2022)“…Cardiovascular disease (CVD) is a leading cause of death worldwide. It is predicted that approximately 23.6 million people will die from CVDs annually by 2030…”
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Identifying patient subgroups in MASLD and MASH-associated fibrosis: molecular profiles and implications for drug development
Published in Scientific reports (07-10-2024)“…The incidence of MASLD and MASH-associated fibrosis is rapidly increasing worldwide. Drug therapy is hampered by large patient variability and partial…”
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Integrating text mining with network models for successful target identification: in vitro validation in MASH-induced liver fibrosis
Published in Frontiers in pharmacology (27-09-2024)“…An target discovery pipeline was developed by including a directional and weighted molecular disease network for metabolic dysfunction-associated…”
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Homology Modeling of Rat and Human Cytochrome P450 2D (CYP2D) Isoforms and Computational Rationalization of Experimental Ligand-Binding Specificities
Published in Journal of medicinal chemistry (02-01-2003)“…The ligand-binding characteristics of rat and human CYP2D isoforms, i.e., rat CYP2D1−4 and human CYP2D6, were investigated by measuring IC50 values of 11 known…”
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Identification of Ligand-binding Site III on the Immunoglobulin-like Domain of the Granulocyte Colony-stimulating Factor Receptor
Published in The Journal of biological chemistry (28-09-2001)“…The granulocyte colony-stimulating factor receptor (G-CSF-R) forms a tetrameric complex with G-CSF containing two ligand and two receptor molecules. The…”
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Target–drug interactions: first principles and their application to drug discovery
Published in Drug discovery today (2012)“…In this review, we begin by introducing the basic principles of kinetics and thermodynamics of target–drug binding within the context of drug discovery. In…”
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Design, Synthesis, and Characterization of 7-Methoxy-4-(aminomethyl)coumarin as a Novel and Selective Cytochrome P450 2D6 Substrate Suitable for High-Throughput Screening
Published in Chemical research in toxicology (01-07-1999)“…In this study, a selective substrate for cytochrome P450 2D6 was designed using a small molecule model developed by M. J. De Groot et al. [(1997) Chem. Res…”
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Influence of N-Substitution of 7-Methoxy-4-(aminomethyl)-coumarin on Cytochrome P450 Metabolism and Selectivity
Published in Drug metabolism and disposition (01-12-2000)“…A series of six structural analogs of 7-methoxy-4-(aminomethyl)-coumarin (MAMC), a recently developed high-throughput substrate of P450 2D6 (CYP2D6), was…”
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Targettri: A toxicity-based triaging system for novel drug targets
Published in Journal of pharmacological and toxicological methods (01-09-2018)Get full text
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Analysis of HSP90 using a toxicity-based triaging approach for drug targets
Published in Toxicology letters (20-10-2017)Get full text
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Assessment of Scaffold Hopping Efficiency by Use of Molecular Interaction Fingerprints
Published in Journal of medicinal chemistry (12-06-2008)“…A novel scoring algorithm based on molecular interaction fingerprints (IFPs) was comparatively evaluated in its scaffold hopping efficiency against four…”
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Assessment of a Novel Scoring Method Based on Solvent Accessible Surface Area Descriptors
Published in Journal of chemical information and modeling (26-04-2010)“…A novel scoring algorithm based on unique solvent accessible surface area (SASA) descriptors was comparatively evaluated for its database enrichment potential…”
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N′-(Arylsulfonyl)pyrazoline-1-carboxamidines as Novel, Neutral 5-Hydroxytryptamine 6 Receptor (5-HT6R) Antagonists with Unique Structural Features
Published in Journal of medicinal chemistry (27-10-2011)“…The 5-HT6 receptor (5-HT6R) has been in the spotlight for several years regarding CNS-related diseases. We set out to discover novel, neutral 5-HT6R…”
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A holistic approach to the safety assessment of exploratory drug targets
Published in Journal of pharmacological and toxicological methods (01-09-2016)Get full text
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Optimization of N'-(arylsulfonyl)pyrazoline-1-carboxamidines by exploiting a novel interaction site in the 5-HT sub(6) antagonistic binding pocket
Published in Bioorganic & medicinal chemistry letters (15-03-2016)“…The discovery of non-basic N'-(arylsulfonyl)pyrazoline-1-carboxamidines as 5-HT sub(6) antagonists with unique structural features was recently disclosed. Here…”
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Optimization of N′-(arylsulfonyl)pyrazoline-1-carboxamidines by exploiting a novel interaction site in the 5-HT6 antagonistic binding pocket
Published in Bioorganic & medicinal chemistry letters (15-03-2016)“…[Display omitted] The discovery of non-basic N′-(arylsulfonyl)pyrazoline-1-carboxamidines as 5-HT6 antagonists with unique structural features was recently…”
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Design of a High Fragment Efficiency Library by Molecular Graph Theory
Published in ACS medicinal chemistry letters (09-12-2010)“…Molecular graph theory was used to design a unique and diverse, high-efficiency fragment screening collection. A data set retrieved from the annotated database…”
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Biophysical and physicochemical methods differentiate highly ligand-efficient human D-amino acid oxidase inhibitors
Published in European journal of medicinal chemistry (01-10-2011)“…Many early drug research efforts are too reductionist thereby not delivering key parameters such as kinetics and thermodynamics of target–ligand binding. A set…”
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