Zobrazeno 1 - 10
of 44
pro vyhledávání: '"Peteris Prusis"'
Autor:
Aleksejs Kontijevskis, Peteris Prusis, Ramona Petrovska, Sviatlana Yahorava, Felikss Mutulis, Ilze Mutule, Jan Komorowski, Jarl E S Wikberg
Publikováno v:
PLoS Computational Biology, Vol 3, Iss 3, p e48 (2007)
Retroviruses affect a large number of species, from fish and birds to mammals and humans, with global socioeconomic negative impacts. Here the authors report and experimentally validate a novel approach for the analysis of the molecular networks that
Externí odkaz:
https://doaj.org/article/18066dc6932c470e83555e01188865cd
Autor:
Andreas Bender, Peteris Prusis, Qurrat Ul Ain, Gerd Wohlfahrt, Helena Henno, Lars-Olof Pietilä, Julian E. Fuchs, Vigneshwari Subramanian
Publikováno v:
MedChemComm. 8:1037-1045
The high similarity between certain sub-pockets of serine proteases may lead to low selectivity of protease inhibitors. Therefore the application of proteochemometrics (PCM), which quantifies the relationship between protein/ligand descriptors and af
Autor:
Marta Olszak-Płachta, Mateusz Nowak, Hugh Chapman, Magdalena Sieprawska-Lupa, Raymond Horvath, Klaudia Stefańska, Maciej Mikulski, Marcin Król, Katja Kuokkanen, Michal Galezowski, Mariusz Galek, Niina Jalava, Justyna Adamczyk, Joanna Szeremeta-Spisak, Ullamari Pesonen, Josef Messinger, Harri Salo, Radosław Obuchowicz, Charles-Henry Fabritius, Anna Buda, Peteris Prusis, Timo Korjamo
Publikováno v:
Bioorganic & Medicinal Chemistry Letters. 26:2610-2615
A series of 1-Sulfonyl-6-Piperazinyl-7-Azaindoles, showing strong antagonistic activity to 5-HT6 receptor (5-HT6R) was synthesized and characterized. The series was optimized to reduce activity on D2 receptor. Based on the selectivity against this of
Publikováno v:
MedChemComm. 7:1007-1015
Proteochemometrics, a method that simultaneously uses protein and ligand description, was used to model the target-ligand interaction space of 95 kinases and 1572 inhibitors. To build models, we applied 3-dimensional field-based description of the re
Publikováno v:
Journal of Chemical Information and Modeling. 53:3021-3030
Achieving selectivity for small organic molecules toward biological targets is a main focus of drug discovery but has been proven difficult, for example, for kinases because of the high similarity of their ATP binding pockets. To support the design o
Autor:
Peteris Prusis, Lovisa Afzelius
Publikováno v:
QSAR & Combinatorial Science. 28:865-868
Metabolism plays a significant role in failure of drugs to carry out their intended action in the body. Drugs and other xenobiotics in the body are mainly biotransformed through oxidation reactions catalyzed by cytochrome P450 enzymes, in particular
Publikováno v:
Journal of Peptide Science. 14:786-796
We demonstrate the use of statistical molecular design (SMD) in the selection of peptide libraries aimed to systematically investigate antigen-antibody binding spaces. Earlier, we derived two novel antibodies by mutating the complementarity-determini
Publikováno v:
Journal of Molecular Recognition. 20:97-102
The aim of this study was to develop predictive quantitative structure-activity relationship (QSAR) modeling for antibody-peptide interactions. A small single chain antibody library was designed and manufactured around the murine anti-p24 (HIV-1) mon
Autor:
Peteris Prusis, Pornwaratt Niyomrattanakit, Jarl E. S. Wikberg, Gerd Katzenmeier, Ilze Mutule, Sviatlana Yahorava, Felikss Mutulis, Ramona Petrovska
Publikováno v:
Biochemical Journal. 397:203-211
The NS3 (dengue virus non-structural protein 3) serine protease of dengue virus is an essential component for virus maturation, thus representing an attractive target for the development of antiviral drugs directed at the inhibition of polyprotein pr
Publikováno v:
Bioinformatics. 21:4289-4296
Motivation: Proteochemometrics is a novel technology for the analysis of interactions of series of proteins with series of ligands. We have here customized it for analysis of large datasets and evaluated it for the modeling of the interaction of psyc