Computational Chemogenomics Drug Repositioning Strategy Enables the Discovery of Epirubicin as a New Repurposed Hit for Plasmodium falciparum and P. vivax.
DNA gyrase
chemogenomics
drug repositioning
epirubicin
malaria
Journal
Antimicrobial agents and chemotherapy
ISSN: 1098-6596
Titre abrégé: Antimicrob Agents Chemother
Pays: United States
ID NLM: 0315061
Informations de publication
Date de publication:
20 08 2020
20 08 2020
Historique:
received:
11
10
2019
accepted:
19
06
2020
pubmed:
1
7
2020
medline:
22
6
2021
entrez:
1
7
2020
Statut:
epublish
Résumé
Widespread resistance against antimalarial drugs thwarts current efforts for controlling the disease and urges the discovery of new effective treatments. Drug repositioning is increasingly becoming an attractive strategy since it can reduce costs, risks, and time-to-market. Herein, we have used this strategy to identify novel antimalarial hits. We used a comparative
Identifiants
pubmed: 32601162
pii: AAC.02041-19
doi: 10.1128/AAC.02041-19
pmc: PMC7449180
pii:
doi:
Substances chimiques
Antimalarials
0
Epirubicin
3Z8479ZZ5X
Types de publication
Journal Article
Research Support, Non-U.S. Gov't
Langues
eng
Sous-ensembles de citation
IM
Commentaires et corrections
Type : ErratumIn
Informations de copyright
Copyright © 2020 American Society for Microbiology.
Références
PLoS One. 2013;8(3):e59288
pubmed: 23555651
PLoS Biol. 2011 Aug;9(8):e1001138
pubmed: 21912516
Nucleic Acids Res. 2019 Jan 8;47(D1):D506-D515
pubmed: 30395287
Drug Discov Today. 2013 Feb;18(3-4):110-5
pubmed: 22935104
Lancet Infect Dis. 2009 Sep;9(9):555-66
pubmed: 19695492
Science. 1976 Aug 20;193(4254):673-5
pubmed: 781840
Nucleic Acids Res. 2016 Jan 4;44(D1):D1202-13
pubmed: 26400175
PLoS Negl Trop Dis. 2015 Jan 08;9(1):e3435
pubmed: 25569258
Mol Cell Biol. 1984 Nov;4(11):2381-8
pubmed: 6096695
Mem Inst Oswaldo Cruz. 2015 Feb;110(1):23-47
pubmed: 25742262
Nucleic Acids Res. 2012 Jan;40(Database issue):D400-12
pubmed: 22140110
Nucleic Acids Res. 2012 Jan;40(Database issue):D1118-27
pubmed: 22116064
Int J Parasitol Drugs Drug Resist. 2014 Mar 24;4(2):95-111
pubmed: 25057459
J Chem Inf Model. 2010 Jul 26;50(7):1189-204
pubmed: 20572635
Cancer Res. 1992 Jan 1;52(1):194-201
pubmed: 1727379
Mem Inst Oswaldo Cruz. 2012 Nov;107(7):859-66
pubmed: 23147140
Malar J. 2013 Jun 06;12:187
pubmed: 23742293
Front Pharmacol. 2018 Mar 06;9:146
pubmed: 29559909
Malar J. 2008 May 19;7:81
pubmed: 18489748
Top Curr Chem. 2008;283:191-206
pubmed: 23605633
J Mol Graph. 1996 Feb;14(1):33-8, 27-8
pubmed: 8744570
J Comput Aided Mol Des. 2013 Mar;27(3):221-34
pubmed: 23579614
Comput Struct Biotechnol J. 2019 Feb 08;17:352-361
pubmed: 30949306
Curr Med Chem. 2019;26(23):4355-4379
pubmed: 29521204
Biomed Res Int. 2015;2015:965725
pubmed: 25918726
Nat Rev Drug Discov. 2015 Nov;14(11):751-8
pubmed: 26435527
Proteins. 2016 Sep;84(9):1177-89
pubmed: 27018641
Front Microbiol. 2019 Jun 12;10:1301
pubmed: 31244810
Biol Direct. 2016 Aug 04;11:36
pubmed: 27492357
PLoS One. 2013;8(2):e56916
pubmed: 23451110
J Biol Chem. 1990 Aug 25;265(24):14250-5
pubmed: 2167312
Acta Crystallogr D Biol Crystallogr. 2010 Jan;66(Pt 1):12-21
pubmed: 20057044
J Med Chem. 2006 Oct 19;49(21):6177-96
pubmed: 17034125
Nucleic Acids Res. 2007 Jul;35(Web Server issue):W375-83
pubmed: 17452350
Nucleic Acids Res. 2014 Jan;42(Database issue):D1091-7
pubmed: 24203711
Emerg Infect Dis. 2007 Jul;13(7):1125-6
pubmed: 18214203
Bioinformatics. 1998;14(1):40-7
pubmed: 9520500
Exp Parasitol. 2001 Jun;98(2):110-4
pubmed: 11465994
Nat Struct Mol Biol. 2018 Mar;25(3):217-224
pubmed: 29459785
Nature. 2016 Jun 14;534(7607):314-6
pubmed: 27306171
Ann Trop Med Parasitol. 1975 Jun;69(2):155-71
pubmed: 1098584
Cell Biol Toxicol. 2007 Jan;23(1):49-62
pubmed: 17031515
J Med Chem. 2011 Jul 14;54(13):4399-426
pubmed: 21630666
Exp Parasitol. 2007 Mar;115(3):310-3
pubmed: 17049517
Invest New Drugs. 1996;14(2):139-46
pubmed: 8913834
Malar J. 2017 Jan 13;16(1):26
pubmed: 28086874
J Chem Inf Model. 2016 Jul 25;56(7):1243-52
pubmed: 27280890
Acta Trop. 2015 Sep;149:113-27
pubmed: 25963804
Acta Crystallogr D Struct Biol. 2016 Apr;72(Pt 4):488-96
pubmed: 27050128
Cold Spring Harb Protoc. 2018 Jun 1;2018(6):
pubmed: 29858338
Proc Natl Acad Sci U S A. 2008 Jul 1;105(26):9059-64
pubmed: 18579783
PLoS One. 2017 Oct 31;12(10):e0186364
pubmed: 29088219
Biochem Pharmacol. 2001 Apr 15;61(8):933-8
pubmed: 11286984
Curr Opin Infect Dis. 2009 Oct;22(5):430-5
pubmed: 19571748
Emerg Infect Dis. 2010 Oct;16(10):1611-4
pubmed: 20875292
Nucleic Acids Res. 2010 Jan;38(Database issue):D255-66
pubmed: 19933261
J Antimicrob Chemother. 2018 Feb 1;73(2):395-403
pubmed: 29177421
Science. 1986 Aug 8;233(4764):647-9
pubmed: 3014661
Am J Trop Med Hyg. 2011 Apr;84(4):517-31
pubmed: 21460003
Nucleic Acids Res. 2010 Jul;38(Web Server issue):W529-33
pubmed: 20478830
Antimicrob Agents Chemother. 2018 Oct 24;62(11):
pubmed: 30181368
Nucleic Acids Res. 2018 Jan 4;46(D1):D1121-D1127
pubmed: 29140520
Nucleic Acids Res. 2012 Jul;40(Web Server issue):W294-7
pubmed: 22649060
Biochim Biophys Acta. 1980 Apr 30;607(2):206-14
pubmed: 7370266
Nat Chem Biol. 2015 Aug;11(8):535
pubmed: 26196763
Nucleic Acids Res. 2014 Jul;42(Web Server issue):W252-8
pubmed: 24782522
Oncogene. 2013 Jan 17;32(3):375-87
pubmed: 22370641
Nucleic Acids Res. 2018 Jul 2;46(W1):W296-W303
pubmed: 29788355
Curr Pharm Des. 2007;13(34):3494-504
pubmed: 18220786
Antimicrob Agents Chemother. 2003 Jan;47(1):170-3
pubmed: 12499187
J Comput Chem. 2005 Dec;26(16):1752-80
pubmed: 16211539
Am J Trop Med Hyg. 1963 Mar;12:121-8
pubmed: 14021822
PLoS Comput Biol. 2018 Oct 22;14(10):e1006515
pubmed: 30346968
Proc Natl Acad Sci U S A. 2005 Feb 1;102(5):1548-53
pubmed: 15665075
Drugs. 1993 May;45(5):788-856
pubmed: 7686469
Expert Rev Anticancer Ther. 2004 Apr;4(2):189-95
pubmed: 15056049
Nucleic Acids Res. 2011 Jan;39(Database issue):D1035-41
pubmed: 21059682
Antimicrob Agents Chemother. 2014;58(1):342-7
pubmed: 24165179
Microbiol Res. 2014 Feb-Mar;169(2-3):107-20
pubmed: 24360837
Nat Genet. 1999 Mar;21(3):278-83
pubmed: 10080179
Bioinformatics. 2003 Jan;19(1):163-4
pubmed: 12499312
Parasitol Int. 2015 Jun;64(3):254-9
pubmed: 25451217
Curr Clin Microbiol Rep. 2014 Dec 1;1(3-4):37-50
pubmed: 25893156
Nat Chem Biol. 2009 Oct;5(10):765-71
pubmed: 19734910
Antimicrob Agents Chemother. 2013 Oct;57(10):5170-4
pubmed: 23877705