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The CDR3 region as the major driver of TREM-1 interaction with its ligands, an in silico characterization.
de Oliveira Matos A, Dos Santos Dantas PH, Colmenares MTC, Sartori GR, Silva-Sales M, Da Silva JHM, Neves BJ, Andrade CH, Sales-Campos H. de Oliveira Matos A, et al. Among authors: andrade ch. Comput Struct Biotechnol J. 2023 Apr 13;21:2579-2590. doi: 10.1016/j.csbj.2023.04.008. eCollection 2023. Comput Struct Biotechnol J. 2023. PMID: 37122631 Free PMC article.
Natural products as leads in schistosome drug discovery.
Neves BJ, Andrade CH, Cravo PV. Neves BJ, et al. Among authors: andrade ch. Molecules. 2015 Jan 23;20(2):1872-903. doi: 10.3390/molecules20021872. Molecules. 2015. PMID: 25625682 Free PMC article.
Modern approaches to accelerate discovery of new antischistosomal drugs.
Neves BJ, Muratov E, Machado RB, Andrade CH, Cravo PV. Neves BJ, et al. Among authors: andrade ch. Expert Opin Drug Discov. 2016 Jun;11(6):557-67. doi: 10.1080/17460441.2016.1178230. Epub 2016 May 3. Expert Opin Drug Discov. 2016. PMID: 27073973 Free PMC article. Review.
QSAR-Driven Discovery of Novel Chemical Scaffolds Active against Schistosoma mansoni.
Melo-Filho CC, Dantas RF, Braga RC, Neves BJ, Senger MR, Valente WC, Rezende-Neto JM, Chaves WT, Muratov EN, Paveley RA, Furnham N, Kamentsky L, Carpenter AE, Silva-Junior FP, Andrade CH. Melo-Filho CC, et al. Among authors: andrade ch. J Chem Inf Model. 2016 Jul 25;56(7):1357-72. doi: 10.1021/acs.jcim.6b00055. Epub 2016 Jun 16. J Chem Inf Model. 2016. PMID: 27253773 Free PMC article.
Discovery of New Anti-Schistosomal Hits by Integration of QSAR-Based Virtual Screening and High Content Screening.
Neves BJ, Dantas RF, Senger MR, Melo-Filho CC, Valente WC, de Almeida AC, Rezende-Neto JM, Lima EF, Paveley R, Furnham N, Muratov E, Kamentsky L, Carpenter AE, Braga RC, Silva-Junior FP, Andrade CH. Neves BJ, et al. Among authors: andrade ch. J Med Chem. 2016 Aug 11;59(15):7075-88. doi: 10.1021/acs.jmedchem.5b02038. Epub 2016 Jul 22. J Med Chem. 2016. PMID: 27396732 Free PMC article.
Analogues of Marine Guanidine Alkaloids Are in Vitro Effective against Trypanosoma cruzi and Selectively Eliminate Leishmania (L.) infantum Intracellular Amastigotes.
Martins LF, Mesquita JT, Pinto EG, Costa-Silva TA, Borborema SE, Galisteo Junior AJ, Neves BJ, Andrade CH, Shuhaib ZA, Bennett EL, Black GP, Harper PM, Evans DM, Fituri HS, Leyland JP, Martin C, Roberts TD, Thornhill AJ, Vale SA, Howard-Jones A, Thomas DA, Williams HL, Overman LE, Berlinck RG, Murphy PJ, Tempone AG. Martins LF, et al. Among authors: andrade ch. J Nat Prod. 2016 Sep 23;79(9):2202-10. doi: 10.1021/acs.jnatprod.6b00256. Epub 2016 Sep 2. J Nat Prod. 2016. PMID: 27586460 Free article.
Illustrating and homology modeling the proteins of the Zika virus.
Ekins S, Liebler J, Neves BJ, Lewis WG, Coffee M, Bienstock R, Southan C, Andrade CH. Ekins S, et al. Among authors: andrade ch. F1000Res. 2016 Mar 3;5:275. doi: 10.12688/f1000research.8213.2. eCollection 2016. F1000Res. 2016. PMID: 27746901 Free PMC article.
133 results