Zobrazeno 1 - 10
of 313
pro vyhledávání: '"Thierry Langer"'
Autor:
Eduardo R. Perez Gonzalez, Bernhard Reck, Predrag Kalaba, Thierry Langer, Johann Leban, Gert Lubec
Publikováno v:
ACS Omega, Vol 9, Iss 11, Pp 12976-12983 (2024)
Externí odkaz:
https://doaj.org/article/da11b6c4b27740f188034b91c23b8dd8
Autor:
Yevhenii Vaksler, Halyna V. Hryhoriv, Vladimir V. Ivanov, Sergiy M. Kovalenko, Victoriya A. Georgiyants, Thierry Langer
Publikováno v:
Acta Crystallographica Section E: Crystallographic Communications, Vol 79, Iss 3, Pp 192-200 (2023)
The title compound, C30H33N4O2F, can be obtained via a two-step synthetic scheme involving 1-benzyl-6-fluoro-4-oxo-7-(piperidin-1-yl)-1,4-dihydroquinoline-3-carbonitrile as a starting compound that undergoes substitution with hydroxylamine and subseq
Externí odkaz:
https://doaj.org/article/1864c768f2e747788d4792d214d610ef
Autor:
István Gyertyán, Jana Lubec, Alíz Judit Ernyey, Christopher Gerner, Ferenc Kassai, Predrag Kalaba, Kata Kozma, Iva Cobankovic, Gábor Brenner, Judith Wackerlig, Eva Franschitz, Ernst Urban, Thierry Langer, Jovana Malikovic, Gert Lubec
Publikováno v:
Scientific Reports, Vol 11, Iss 1, Pp 1-13 (2021)
Abstract The lack of novel cognitive enhancer drugs in the clinic highlights the prediction problems of animal assays. The objective of the current study was to test a putative cognitive enhancer in a rodent cognitive test system with improved transl
Externí odkaz:
https://doaj.org/article/8de4d2688112472988785def180b9487
Autor:
Predrag Kalaba, Katharina Pacher, Philip John Neill, Vladimir Dragacevic, Martin Zehl, Judith Wackerlig, Michael Kirchhofer, Simone B. Sartori, Hubert Gstach, Shima Kouhnavardi, Anna Fabisikova, Matthias Pillwein, Francisco Monje-Quiroga, Karl Ebner, Alexander Prado-Roller, Nicolas Singewald, Ernst Urban, Thierry Langer, Christian Pifl, Jana Lubec, Johann Jakob Leban, Gert Lubec
Publikováno v:
Biomolecules, Vol 13, Iss 9, p 1415 (2023)
The high structural similarity, especially in transmembrane regions, of dopamine, norepinephrine, and serotonin transporters, as well as the lack of all crystal structures of human isoforms, make the specific targeting of individual transporters rath
Externí odkaz:
https://doaj.org/article/206825143bfe4497bebe4460b140ad5d
Publikováno v:
Journal of Cheminformatics, Vol 13, Iss 1, Pp 1-14 (2021)
Abstract QSAR methods are widely applied in the drug discovery process, both in the hit‐to‐lead and lead optimization phase, as well as in the drug-approval process. Most QSAR algorithms are limited to using molecules as input and disregard pharm
Externí odkaz:
https://doaj.org/article/672fd38461d54ceea62874e4a84ed33d
Publikováno v:
Frontiers in Chemistry, Vol 10 (2022)
Enumerating protonation states and calculating microstate pKa values of small molecules is an important yet challenging task for lead optimization and molecular modeling. Commercial and non-commercial solutions have notable limitations such as restri
Externí odkaz:
https://doaj.org/article/2b48aacc2e4446eda823db2ed0d7e0fa
Autor:
Filip Koniuszewski, Florian D. Vogel, Konstantina Bampali, Jure Fabjan, Thomas Seidel, Petra Scholze, Philip B. Schmiedhofer, Thierry Langer, Margot Ernst
Publikováno v:
Frontiers in Molecular Biosciences, Vol 9 (2022)
Background: Human pentameric ligand-gated ion channels (pLGICs) comprise nicotinic acetylcholine receptors (nAChRs), 5-hydroxytryptamine type 3 receptors (5-HT3Rs), zinc-activated channels (ZAC), γ-aminobutyric acid type A receptors (GABAARs) and gl
Externí odkaz:
https://doaj.org/article/dc54f068c3bd491a9c80831d692e9b36
The virtual screening application for searching potential antiviral agents to treat COVID-19 disease
Autor:
Volodymyr V. Ivanov, Veronika R. Karpina, Svitlana S. Kovalenko, Ihor E. Kuznetsov, Thierry Langer, Louis J.R.M. Maes, Serhii M. Kovalenko, Larysa V. Evseeva
Publikováno v:
Журнал органічної та фармацевтичної хімії, Vol 18, Iss 2, Pp 3-15 (2020)
Aim. To provide a brief literature review regarding the structure of the human coronavirus SARS-CoV-2, the mechanism of its replication and the role of viral proteases in this process; to analyze the ability of the known antiviral agents and compound
Externí odkaz:
https://doaj.org/article/90e7fa9b51f64db99f7a4e763f1e8464
Autor:
Alexandre V. Ivachtchenko, Sergiy M. Kovalenko, Dmitry V. Kravchenko, Oleg D. Mitkin, Vladimir V. Ivanov, Thierry Langer
Publikováno v:
Acta Crystallographica Section E: Crystallographic Communications, Vol 76, Iss 1, Pp 12-17 (2020)
The title compound, C15H22N4O5S, was prepared via alkylation of 3-(chloromethyl)-5-(pentan-3-yl)-1,2,4-oxadiazole in anhydrous dioxane in the presence of triethylamine. The thiadiazine ring has an envelope conformation with the S atom displaced by 0.
Externí odkaz:
https://doaj.org/article/2d9eab74010f4535842a0f89b10e00a2
Autor:
Kamonpan Sanachai, Tuanjai Somboon, Patcharin Wilasluck, Peerapon Deetanya, Peter Wolschann, Thierry Langer, Vannajan Sanghiran Lee, Kittikhun Wangkanont, Thanyada Rungrotmongkol, Supot Hannongbua
Publikováno v:
PLoS ONE, Vol 17, Iss 6, p e0269563 (2022)
SARS-CoV-2 causes the current global pandemic coronavirus disease 2019. Widely-available effective drugs could be a critical factor in halting the pandemic. The main protease (3CLpro) plays a vital role in viral replication; therefore, it is of great
Externí odkaz:
https://doaj.org/article/82b761e49390410ea92abd4015017d0b