Detalhe da pesquisa
1.
Targeting SARS-CoV-2 Main Protease: A Successful Story Guided by an In Silico Drug Repurposing Approach.
J Chem Inf Model
; 63(11): 3601-3613, 2023 06 12.
Artigo
em Inglês
| MEDLINE | ID: mdl-37227780
2.
Hit identification of novel small molecules interfering with MALAT1 triplex by a structure-based virtual screening.
Arch Pharm (Weinheim)
; 356(8): e2300134, 2023 08.
Artigo
em Inglês
| MEDLINE | ID: mdl-37309243
3.
Targeting SARS-CoV-2 nsp13 Helicase and Assessment of Druggability Pockets: Identification of Two Potent Inhibitors by a Multi-Site In Silico Drug Repurposing Approach.
Molecules
; 27(21)2022 Nov 03.
Artigo
em Inglês
| MEDLINE | ID: mdl-36364347
4.
Key genetic elements, single and in clusters, underlying geographically dependent SARS-CoV-2 genetic adaptation and their impact on binding affinity for drugs and immune control.
J Antimicrob Chemother
; 76(2): 396-412, 2021 01 19.
Artigo
em Inglês
| MEDLINE | ID: mdl-33254234
5.
Current status of antivirals and druggable targets of SARS CoV-2 and other human pathogenic coronaviruses.
Drug Resist Updat
; 53: 100721, 2020 12.
Artigo
em Inglês
| MEDLINE | ID: mdl-33132205
6.
Ligand binding to telomeric G-quadruplex DNA investigated by funnel-metadynamics simulations.
Proc Natl Acad Sci U S A
; 114(11): E2136-E2145, 2017 03 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-28232513
7.
Natural Products Extracted from Fungal Species as New Potential Anti-Cancer Drugs: A Structure-Based Drug Repurposing Approach Targeting HDAC7.
Molecules
; 25(23)2020 Nov 25.
Artigo
em Inglês
| MEDLINE | ID: mdl-33255661
8.
Multi-Targeting Bioactive Compounds Extracted from Essential Oils as Kinase Inhibitors.
Molecules
; 25(9)2020 May 06.
Artigo
em Inglês
| MEDLINE | ID: mdl-32384767
9.
Pathway involving the N155H mutation in HIV-1 integrase leads to dolutegravir resistance.
J Antimicrob Chemother
; 73(5): 1158-1166, 2018 05 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-29373677
10.
Real-life 3D therapy failure: Analysis of NS5A 93H RAS plus 108 K polymorphism in complex with ombitasvir by molecular modeling.
J Med Virol
; 90(7): 1257-1263, 2018 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-29575060
11.
Identification of G-quadruplex DNA/RNA binders: Structure-based virtual screening and biophysical characterization.
Biochim Biophys Acta Gen Subj
; 1861(5 Pt B): 1329-1340, 2017 May.
Artigo
em Inglês
| MEDLINE | ID: mdl-28025082
12.
Incomplete APOBEC3G/F Neutralization by HIV-1 Vif Mutants Facilitates the Genetic Evolution from CCR5 to CXCR4 Usage.
Antimicrob Agents Chemother
; 59(8): 4870-81, 2015 Aug.
Artigo
em Inglês
| MEDLINE | ID: mdl-26055363
13.
SI113, a specific inhibitor of the Sgk1 kinase activity that counteracts cancer cell proliferation.
Cell Physiol Biochem
; 35(5): 2006-18, 2015.
Artigo
em Inglês
| MEDLINE | ID: mdl-25871776
14.
New raltegravir resistance pathways induce broad cross-resistance to all currently used integrase inhibitors.
J Antimicrob Chemother
; 69(8): 2118-22, 2014 Aug.
Artigo
em Inglês
| MEDLINE | ID: mdl-24710029
15.
Detecting and understanding genetic and structural features in HIV-1 B subtype V3 underlying HIV-1 co-receptor usage.
Bioinformatics
; 29(4): 451-60, 2013 Feb 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-23297034
16.
Aryl ethynyl anthraquinones: a useful platform for targeting telomeric G-quadruplex structures.
Org Biomol Chem
; 12(22): 3744-54, 2014 Jun 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-24789544
17.
In silico identification and biological evaluation of novel selective serum/glucocorticoid-inducible kinase 1 inhibitors based on the pyrazolo-pyrimidine scaffold.
J Chem Inf Model
; 54(7): 1828-32, 2014 Jul 28.
Artigo
em Inglês
| MEDLINE | ID: mdl-24896223
18.
Structure-based virtual screening of novel natural alkaloid derivatives as potential binders of h-telo and c-myc DNA G-quadruplex conformations.
Molecules
; 20(1): 206-23, 2014 Dec 24.
Artigo
em Inglês
| MEDLINE | ID: mdl-25547724
19.
The Histone Deacetylase Family: Structural Features and Application of Combined Computational Methods.
Pharmaceuticals (Basel)
; 17(5)2024 May 10.
Artigo
em Inglês
| MEDLINE | ID: mdl-38794190
20.
Identification of a rare mutation at reverse transcriptase Lys65 (K65E) in HIV-1-infected patients failing on nucleos(t)ide reverse transcriptase inhibitors.
J Antimicrob Chemother
; 68(10): 2199-204, 2013 Oct.
Artigo
em Inglês
| MEDLINE | ID: mdl-23749955