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المؤلفون: Gilles Hanquet, Gabriela Addová, Matúš Hlaváč, Marta Soltesova Prnova, Milan Stefek, Lucia Kovacikova, Andrej Boháč
المساهمون: Laboratoire d'innovation moléculaire et applications (LIMA), Université de Strasbourg (UNISTRA)-Université de Haute-Alsace (UHA) Mulhouse - Colmar (Université de Haute-Alsace (UHA))-Institut de Chimie du CNRS (INC)-Centre National de la Recherche Scientifique (CNRS), Hanquet, Gilles
المصدر: Bioorganic and Medicinal Chemistry
Bioorganic and Medicinal Chemistry, Elsevier, 2020
Bioorganic and Medicinal Chemistry, Elsevier, 2021, 29, pp.115885. ⟨10.1016/j.bmc.2020.115885⟩مصطلحات موضوعية: Male, Indoles, Stereochemistry, N-benzyl(oxotriazinoindole) ALR2 inhibitors, [SDV]Life Sciences [q-bio], Clinical Biochemistry, Pharmaceutical Science, 01 natural sciences, Biochemistry, chemistry.chemical_compound, Structure-Activity Relationship, desolvation penalty, Aldehyde Reductase, Drug Discovery, [CHIM] Chemical Sciences, Lens, Crystalline, Animals, [CHIM]Chemical Sciences, Desolvation, Enzyme Inhibitors, Rats, Wistar, Molecular Biology, ComputingMilieux_MISCELLANEOUS, chemistry.chemical_classification, Aldose reductase, Dose-Response Relationship, Drug, Molecular Structure, 010405 organic chemistry, Triazines, aldose reductase (ALR2), Organic Chemistry, 0104 chemical sciences, Rats, [SDV] Life Sciences [q-bio], Molecular Docking Simulation, 010404 medicinal & biomolecular chemistry, Enzyme, chemistry, Molecular Medicine, interactive pocket, Selectivity, Lead compound
وصف الملف: application/pdf
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المؤلفون: Juraj Dobiaš, Miroslav Murár, Andrej Boháč, Juraj Kóňa, Marek Ondruš, Matúš Hlaváč, Gabriela Addová
المصدر: Chemical Papers. 73:71-84
مصطلحات موضوعية: Stereochemistry, medicine.drug_class, Ligand, General Chemical Engineering, Protein Data Bank (RCSB PDB), Substituent, Carboxamide, 02 engineering and technology, General Chemistry, Salt bridge (protein and supramolecular), 010402 general chemistry, 021001 nanoscience & nanotechnology, 01 natural sciences, Biochemistry, Industrial and Manufacturing Engineering, 0104 chemical sciences, chemistry.chemical_compound, chemistry, Amide, Materials Chemistry, medicine, 0210 nano-technology, Conformational isomerism, Oxazole
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المؤلفون: Lucia Kovacikova, Matúš Hlaváč, Marta Soltesova Prnova, Peter Šramel, Milan Stefek, Gabriela Addová, Gilles Hanquet, Magdalena Majekova, Andrej Boháč
المساهمون: Laboratoire d'innovation moléculaire et applications (LIMA), Université de Strasbourg (UNISTRA)-Université de Haute-Alsace (UHA) Mulhouse - Colmar (Université de Haute-Alsace (UHA))-Institut de Chimie du CNRS (INC)-Centre National de la Recherche Scientifique (CNRS)
المصدر: Journal of Medicinal Chemistry
Journal of Medicinal Chemistry, American Chemical Society, 2020, 63, pp.369-381. ⟨10.1021/acs.jmedchem.9b01747⟩
Journal of Medicinal Chemistry, American Chemical Society, 2020, 63 (1), pp.369-381. ⟨10.1021/acs.jmedchem.9b01747⟩مصطلحات موضوعية: Male, 6-b]indol-5(3H)-yl)acetic acid (4, Indoles, Stereochemistry, [SDV]Life Sciences [q-bio], chemistry.chemical_element, 01 natural sciences, Oxygen, CMTI). 1, 03 medical and health sciences, Polyol pathway, Aldehyde Reductase, Drug Discovery, Lens, Crystalline, cemtirestat, Animals, Humans, [CHIM]Chemical Sciences, Sulfhydryl Compounds, Enzyme Inhibitors, Rats, Wistar, ComputingMilieux_MISCELLANEOUS, 030304 developmental biology, Enzyme Assays, 0303 health sciences, Aldose reductase, Binding Sites, Indoleacetic Acids, 010405 organic chemistry, Chemistry, Triazines, [CHIM.ORGA]Chemical Sciences/Organic chemistry, Sulfur, 3. Good health, 0104 chemical sciences, Molecular Docking Simulation, 4]triazino[5, Figure 1. 2-(3-Thioxo-2H-[1, Docking (molecular), Drug Design, Molecular Medicine, Female, Pharmacophore, Selectivity