Matches in SemOpenAlex for { <https://semopenalex.org/work/W3006513291> ?p ?o ?g. }
- W3006513291 endingPage "633" @default.
- W3006513291 startingPage "611" @default.
- W3006513291 abstract "Abstract During three decades, only about 20 new drugs have been developed for malaria, tuberculosis and all neglected tropical diseases (NTDs). This critical situation was reached because NTDs represent only 10% of health research investments; however, they comprise about 90% of the global disease burden. Computational simulations applied in virtual screening (VS) strategies are very efficient tools to identify pharmacologically active compounds or new indications for drugs already administered for other diseases. One of the advantages of this approach is the low time-consuming and low-budget first stage, which filters for testing experimentally a group of candidate compounds with high chances of binding to the target and present trypanocidal activity. In this work, we review the most common VS strategies that have been used for the identification of new drugs with special emphasis on those applied to trypanosomiasis and leishmaniasis. Computational simulations based on the selected protein targets or their ligands are explained, including the method selection criteria, examples of successful VS campaigns applied to NTDs, a list of validated molecular targets for drug development and repositioned drugs for trypanosomatid-caused diseases. Thereby, here we present the state-of-the-art of VS and drug repurposing to conclude pointing out the future perspectives in the field." @default.
- W3006513291 created "2020-02-24" @default.
- W3006513291 creator A5006328324 @default.
- W3006513291 creator A5034639641 @default.
- W3006513291 creator A5039422182 @default.
- W3006513291 creator A5041380144 @default.
- W3006513291 creator A5075884181 @default.
- W3006513291 creator A5084094933 @default.
- W3006513291 creator A5087258663 @default.
- W3006513291 date "2020-02-12" @default.
- W3006513291 modified "2023-10-14" @default.
- W3006513291 title "Computational approaches for drug discovery against trypanosomatid-caused diseases" @default.
- W3006513291 cites W1031578623 @default.
- W3006513291 cites W10910567 @default.
- W3006513291 cites W1496663395 @default.
- W3006513291 cites W1500036797 @default.
- W3006513291 cites W1508697289 @default.
- W3006513291 cites W1521670561 @default.
- W3006513291 cites W1537276662 @default.
- W3006513291 cites W1575666547 @default.
- W3006513291 cites W1598802578 @default.
- W3006513291 cites W1603759615 @default.
- W3006513291 cites W1604646983 @default.
- W3006513291 cites W17045578 @default.
- W3006513291 cites W1757990252 @default.
- W3006513291 cites W1787875571 @default.
- W3006513291 cites W180482503 @default.
- W3006513291 cites W19471559 @default.
- W3006513291 cites W1954656319 @default.
- W3006513291 cites W1963542761 @default.
- W3006513291 cites W1964326958 @default.
- W3006513291 cites W1965044078 @default.
- W3006513291 cites W1968217711 @default.
- W3006513291 cites W1972433289 @default.
- W3006513291 cites W1973149584 @default.
- W3006513291 cites W1974082931 @default.
- W3006513291 cites W1974884542 @default.
- W3006513291 cites W1975654905 @default.
- W3006513291 cites W1976810913 @default.
- W3006513291 cites W1977759779 @default.
- W3006513291 cites W1981055894 @default.
- W3006513291 cites W1981156641 @default.
- W3006513291 cites W1988206115 @default.
- W3006513291 cites W1989977071 @default.
- W3006513291 cites W1991262449 @default.
- W3006513291 cites W1995734836 @default.
- W3006513291 cites W1998056319 @default.
- W3006513291 cites W1998060839 @default.
- W3006513291 cites W1998848097 @default.
- W3006513291 cites W1999491936 @default.
- W3006513291 cites W1999613945 @default.
- W3006513291 cites W1999975818 @default.
- W3006513291 cites W2002005952 @default.
- W3006513291 cites W2006452977 @default.
- W3006513291 cites W2007520264 @default.
- W3006513291 cites W2008732224 @default.
- W3006513291 cites W2010017271 @default.
- W3006513291 cites W2010193651 @default.
- W3006513291 cites W2014104422 @default.
- W3006513291 cites W2014871786 @default.
- W3006513291 cites W2016292622 @default.
- W3006513291 cites W2026141986 @default.
- W3006513291 cites W2029124536 @default.
- W3006513291 cites W2029589290 @default.
- W3006513291 cites W2029667189 @default.
- W3006513291 cites W2030192015 @default.
- W3006513291 cites W2030711777 @default.
- W3006513291 cites W2032338665 @default.
- W3006513291 cites W2037167896 @default.
- W3006513291 cites W2041696819 @default.
- W3006513291 cites W2042572511 @default.
- W3006513291 cites W2042992947 @default.
- W3006513291 cites W2043509228 @default.
- W3006513291 cites W2044392264 @default.
- W3006513291 cites W2046148059 @default.
- W3006513291 cites W2047713231 @default.
- W3006513291 cites W2050456292 @default.
- W3006513291 cites W2052645253 @default.
- W3006513291 cites W2054356818 @default.
- W3006513291 cites W2055367741 @default.
- W3006513291 cites W2055905702 @default.
- W3006513291 cites W2056403222 @default.
- W3006513291 cites W2057582709 @default.
- W3006513291 cites W2059272675 @default.
- W3006513291 cites W2059765043 @default.
- W3006513291 cites W2060548449 @default.
- W3006513291 cites W2060860218 @default.
- W3006513291 cites W2061771869 @default.
- W3006513291 cites W2062884696 @default.
- W3006513291 cites W2062941476 @default.
- W3006513291 cites W2064922889 @default.
- W3006513291 cites W2074682587 @default.
- W3006513291 cites W2077451644 @default.
- W3006513291 cites W2078260362 @default.
- W3006513291 cites W2078910558 @default.
- W3006513291 cites W2079188013 @default.
- W3006513291 cites W2080120147 @default.
- W3006513291 cites W2090025142 @default.