AI Promoted Virtual Screening, Structure-Based Hit Optimization, and Synthesis of Novel COVID-19 S-RBD Domain Inhibitors.

Autor: Gkekas I; Institute of Applied Biosciences, Centre for Research and Technology Hellas, Thessaloniki 57001, Greece., Katsamakas S; Information Technologies Institute, Centre for Research and Technology Hellas, Thessaloniki 57001, Greece.; Institute of Chemical Biology, National Hellenic Research Foundation, 48 Vassileos Constantinou Avenue, Athens 11635, Greece., Mylonas S; Information Technologies Institute, Centre for Research and Technology Hellas, Thessaloniki 57001, Greece., Fotopoulou T; Institute of Chemical Biology, National Hellenic Research Foundation, 48 Vassileos Constantinou Avenue, Athens 11635, Greece., Magoulas GΕ; Institute of Chemical Biology, National Hellenic Research Foundation, 48 Vassileos Constantinou Avenue, Athens 11635, Greece., Tenchiu AC; Institute of Chemical Biology, National Hellenic Research Foundation, 48 Vassileos Constantinou Avenue, Athens 11635, Greece., Dimitriou M; Laboratory of Biology, Department of Medicine, Democritus University of Thrace, Alexandroupolis 68100, Greece., Axenopoulos A; Information Technologies Institute, Centre for Research and Technology Hellas, Thessaloniki 57001, Greece., Rossopoulou N; Institute of Chemical Biology, National Hellenic Research Foundation, 48 Vassileos Constantinou Avenue, Athens 11635, Greece., Kostova S; Max-Delbrueck-Center for Molecular Medicine in the Helmholtz Association, Berlin 13125, Germany., Wanker EE; Max-Delbrueck-Center for Molecular Medicine in the Helmholtz Association, Berlin 13125, Germany., Katsila T; Institute of Chemical Biology, National Hellenic Research Foundation, 48 Vassileos Constantinou Avenue, Athens 11635, Greece., Papahatjis D; Institute of Chemical Biology, National Hellenic Research Foundation, 48 Vassileos Constantinou Avenue, Athens 11635, Greece., Gorgoulis VG; Molecular Carcinogenesis Group, Department of Histology and Embryology, Medical School, National and Kapodistrian University of Athens, Athens 11635, Greece.; Ninewells Hospital and Medical School, University of Dundee, DD19SY Dundee, U.K., Koufaki M; Institute of Chemical Biology, National Hellenic Research Foundation, 48 Vassileos Constantinou Avenue, Athens 11635, Greece., Karakasiliotis I; Laboratory of Biology, Department of Medicine, Democritus University of Thrace, Alexandroupolis 68100, Greece., Calogeropoulou T; Institute of Chemical Biology, National Hellenic Research Foundation, 48 Vassileos Constantinou Avenue, Athens 11635, Greece., Daras P; Information Technologies Institute, Centre for Research and Technology Hellas, Thessaloniki 57001, Greece., Petrakis S; Institute of Applied Biosciences, Centre for Research and Technology Hellas, Thessaloniki 57001, Greece.

Publikováno v: Journal of chemical information and modeling [J Chem Inf Model] 2024 Nov 25; Vol. 64 (22), pp. 8562-8585. Date of Electronic Publication: 2024 Nov 13.

Differential membrane fluidization by active and inactive cannabinoid analogues

Autor: Mavromoustakos, T ^*, Papahatjis, D, Laggner, P

Publikováno v: In BBA - Biomembranes 2001 1512(2):183-190

Cannabinoids negatively modulate striatal glutamate and dopamine release and behavioural output of acute d-amphetamine

Autor: Polissidis, A. Chouliara, O. Galanopoulos, A. Naxakis, G. Papahatjis, D. Papadopoulou-Daifoti, Z. Antoniou, K.

The cannabinoid system plays a regulatory role in neurotransmission and is involved in the central actions of psychostimulants. This complex interaction between the cannabinoid system and psychostimulants represents a potential pharmacological target

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=od______2127::b917ec655e74448ff5bf14f069bed26f
https://pergamos.lib.uoa.gr/uoa/dl/object/uoadl:2998861

DPS-2: A Novel Dual MEK/ERK and PI3K/AKT Pathway Inhibitor with Powerful Ex Vivo and In Vivo Anticancer Properties.

Autor: Goulielmaki M; Institute of Biology Medicinal Chemistry and Biotechnology, National Hellenic Research Foundation, 116 36 Athens, Greece., Assimomytis N; Institute of Biology Medicinal Chemistry and Biotechnology, National Hellenic Research Foundation, 116 36 Athens, Greece., Rozanc J; TEPA Lefkippos-Demokritos, Patriarchou Grigoriou & Neapoleos, 15343 Ag. Paraskevi, Attiki, Greece., Taki E; Institute of Biology Medicinal Chemistry and Biotechnology, National Hellenic Research Foundation, 116 36 Athens, Greece., Christodoulou I; Institute of Biology Medicinal Chemistry and Biotechnology, National Hellenic Research Foundation, 116 36 Athens, Greece., Alexopoulos LG; TEPA Lefkippos-Demokritos, Patriarchou Grigoriou & Neapoleos, 15343 Ag. Paraskevi, Attiki, Greece; School of Mechanical Engineering, National Technical University of Athens, Zografou 15780, Greece., Zoumpourlis V; Institute of Biology Medicinal Chemistry and Biotechnology, National Hellenic Research Foundation, 116 36 Athens, Greece., Pintzas A; Institute of Biology Medicinal Chemistry and Biotechnology, National Hellenic Research Foundation, 116 36 Athens, Greece., Papahatjis D; Institute of Biology Medicinal Chemistry and Biotechnology, National Hellenic Research Foundation, 116 36 Athens, Greece. Electronic address: dpapah@eie.gr.

Publikováno v: Translational oncology [Transl Oncol] 2019 Jul; Vol. 12 (7), pp. 932-950. Date of Electronic Publication: 2019 May 13.

Behavioral pharmacological properties of a novel cannabinoid 1',1'-dithiolane delta8-THC analog, AMG-3

Autor: Antoniou, K., Galanopoulos, A., Vlachou, S., Kourouli, T., Nahmias, V., Thermos, K., Panagis, G., Daifoti, Z., Marselos, M., Papahatjis, D., Spyraki, C.

Newly developed cannabinoids may hold the promise of the development of useful and safe drugs. This study aimed to investigate the behavioral effects of the novel 1',1'-dithiolane delta8-HC analogue AMG-3, a cannabinomimetic molecule with high affini

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=od_____10561::5402306520c48997d1c15e36b305c594
http://olympias.lib.uoi.gr/jspui/handle/123456789/23524