Zobrazeno 1 - 10
of 26
pro vyhledávání: '"Yoseph Atilaw"'
Autor:
Cheng Peng, Yoseph Atilaw, Jinan Wang, Zhijian Xu, Vasanthanathan Poongavanam, Jiye Shi, Jan Kihlberg, Weiliang Zhu, Máté Erdélyi
Publikováno v:
ACS Omega, Vol 4, Iss 26, Pp 22245-22250 (2019)
Externí odkaz:
https://doaj.org/article/8292ad0dedd24a53b3da9ba095d24b07
Autor:
Yoseph Atilaw, Lois Muiva-Mutisya, Albert Ndakala, Hoseah M. Akala, Redemptah Yeda, Yu J. Wu, Paolo Coghi, Vincent K. W. Wong, Máté Erdélyi, Abiy Yenesew
Publikováno v:
Molecules, Vol 22, Iss 9, p 1514 (2017)
Four new flavones with modified prenyl groups, namely (E)-5-hydroxytephrostachin (1), purleptone (2), (E)-5-hydroxyanhydrotephrostachin (3), and terpurlepflavone (4), along with seven known compounds (5–11), were isolated from the CH2Cl2/MeOH (1:1)
Externí odkaz:
https://doaj.org/article/2b70d6a40e61495a9188a90f65a0f522
Autor:
Yoseph Atilaw, Sandra Duffy, Matthias Heydenreich, Lois Muiva-Mutisya, Vicky M. Avery, Máté Erdélyi, Abiy Yenesew
Publikováno v:
Molecules, Vol 22, Iss 2, p 318 (2017)
In our search for new antiplasmodial agents, the CH2Cl2/CH3OH (1:1) extract of the roots of Tephrosia aequilata was investigated, and observed to cause 100% mortality of the chloroquine-sensitive (3D7) strain of Plasmodium falciparum at a 10 mg/mL co
Externí odkaz:
https://doaj.org/article/5da01b3e7f1f478489d2a77151c0ec36
Autor:
Vasanthanathan Poongavanam, Yoseph Atilaw, Stephan Siegel, Anja Giese, Lutz Lehmann, Daniel Meibom, Mate Erdelyi, Jan Kihlberg
Publikováno v:
Journal of medicinal chemistry. 65(19)
Proteolysis-targeting chimeras (PROTACs) must be cell permeable to reach their target proteins. This is challenging as the bivalent structure of PROTACs puts them in chemical space at, or beyond, the outer limits of oral druggable space. We used NMR
The ability to adjust conformations in response to the polarity of the environment, i.e. molecular chameleonicity, is considered to be important for conferring both high aqueous solubility and high cell permeability to drugs in chemical space beyond
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::c881365cf39d19d9116ae11359e6f99a
Autor:
Daniel Umereweneza, Yoseph Atilaw, Stefan Peintner, Anastasia Rudenko, Catarina Bourgard, Ruisheng Xiong, Théoneste Muhizi, Per Sunnerhagen, Adolf Gogoll, Mate Erdelyi
Three new compounds, the silphiperfolanol angelate ester umutagarananol (1), the macrocyclic pyrrolizidine alkaloids umutagarinine A and B (2–3), and five known secondary metabolites (4–8) were isolated from the CH2Cl2−MeOH (1 : 1) extract of t
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::139f31342443300c7e38388df65e06e7
Autor:
Lianne H. E. Wieske, Máté Erdélyi, Jan Kihlberg, Yoseph Atilaw, Sofie Ye, Giuseppe Ermondi, Vasanthanathan Poongavanam, Giulia Caron
Publikováno v:
Journal of Pharmaceutical Sciences. 110:301-313
Macrocycles constitute superior ligands for targets that have flat binding sites but often require long synthetic routes, emphasizing the need for property prediction prior to synthesis. We have investigated the scope and limitations of machine learn
Autor:
Andreas Luttens, Hjalmar Gullberg, Eldar Abdurakhmanov, Duy Duc Vo, Dario Akaberi, Vladimir O. Talibov, Natalia Nekhotiaeva, Laura Vangeel, Steven De Jonghe, Dirk Jochmans, Janina Krambrich, Ali Tas, Bo Lundgren, Ylva Gravenfors, Alexander J. Craig, Yoseph Atilaw, Anja Sandström, Lindon W. K. Moodie, Åke Lundkvist, Martijn J. van Hemert, Johan Neyts, Johan Lennerstrand, Jan Kihlberg, Kristian Sandberg, U. Helena Danielson, Jens Carlsson
Publikováno v:
Journal of the American Chemical Society, 144(7), 2905-2920. AMER CHEMICAL SOC
Drugs targeting SARS-CoV-2 could have saved millions of lives during the COVID-19 pandemic, and it is now crucial to develop inhibitors of coronavirus replication in preparation for future outbreaks. We explored two virtual screening strategies to fi
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::946c3c3e10aa0c690988b970c049d161
http://hdl.handle.net/1887/3479854
http://hdl.handle.net/1887/3479854
Autor:
Thobias M. Kalenga, Jackson T. Mollel, Joanna Said, Andreas Orthaber, Jas S. Ward, Yoseph Atilaw, Daniel Umereweneza, Monica M. Ndoile, Joan J. E. Munissi, Kari Rissanen, Edward Trybala, Tomas Bergström, Stephen S. Nyandoro, Mate Erdelyi
The leaf extract of Suregada zanzibariensis gave two new modified ent-abietane diterpenoids, zanzibariolides A (1) and B (2), and two known triterpenoids, simiarenol (3) and β-amyrin (4). The structures of the isolated compounds were elucidated base
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::005abdafe4cadeb518a32d9209a5954c
http://urn.fi/URN:NBN:fi:jyu-202209144586
http://urn.fi/URN:NBN:fi:jyu-202209144586
Autor:
Jan Kihlberg, Weiliang Zhu, Zhijian Xu, Máté Erdélyi, Jinan Wang, Jiye Shi, Vasanthanathan Poongavanam, Cheng Peng, Yoseph Atilaw
Publikováno v:
ACS Omega
ACS Omega, Vol 4, Iss 26, Pp 22245-22250 (2019)
ACS Omega, Vol 4, Iss 26, Pp 22245-22250 (2019)
The replica exchange molecular dynamics (REMD) simulation is demonstrated to readily predict the conformations of the macrocyclic drug lorlatinib, as validated by solution NMR studies. In aqueous solution, lorlatinib adopts a conformer identical to i