Identification of Triazolopyrimidinyl Scaffold SARS-CoV-2 Papain-Like Protease (PL pro ) InhibitorArticle Published on 2024-01-252024-09-05 Journal: Pharmaceutics [Category] update2024, [키워드] antiviral design CADD drug design HTVS in silico drug design Papain-like protease PLpro Protease inhibitor SARS-CoV-2 structure-based design Virtual screening [DOI] 10.3390/pharmaceutics16020169 PMC 바로가기 [Article Type] Article
Design of a stabilized RBD enables potently neutralizing SARS-CoV-2 single-component nanoparticle vaccinesArticle Published on 2023-03-062024-09-05 Journal: Cell Reports [Category] update2024, [키워드] glycosylation immunogen nanoparticle SPEEDesign stabilized structural vaccinology structure-based design [DOI] 10.1016/j.celrep.2023.112266 PMC 바로가기 [Article Type] Article
The structure-based design of peptidomimetic inhibitors against SARS-CoV-2 3C like protease as Potent anti-viral drug candidate강력한 항바이러스 약물 후보로서 SARS-CoV-2 3C 유사 프로테아제에 대한 펩티도미메틱 억제제의 구조 기반 설계Article Published on 2022-08-052022-09-11 Journal: European journal of medicinal chemistry [Category] COVID19(2023년), SARS, 치료제, [키워드] 3C Like protease 3CL 3CL pro acute respiratory syndrome coronavirus acute respiratory syndrome coronavirus 2 anti-SARS-CoV-2 Anti-viral anti-viral drug applied complexes Compound coronavirus 2 coronavirus disease Coronavirus disease 2019 COVID-19 deficiency described develop drug candidates effective inhibit inhibitor inhibitors inhibitory activity Like Medicine pathogen Peptidomimetic inhibitors potent Prevent Pro protease Protease inhibitor protein-ligand respiratory SARS-CoV-2 screened Severe acute respiratory syndrome severe acute respiratory syndrome Coronavirus structure-based design targeting the SARS-CoV-2 Transcription treat viral replication X-ray [DOI] 10.1016/j.ejmech.2022.114458 PMC 바로가기 [Article Type] Article
From Repurposing to Redesign: Optimization of Boceprevir to Highly Potent Inhibitors of the SARS-CoV-2 Main Protease용도 변경에서 재설계까지: SARS-CoV-2 주요 프로테아제의 강력한 억제제에 대한 보세프레비르의 최적화Article Published on 2022-07-042022-09-11 Journal: Molecules [Category] COVID19(2023년), SARS, 신약개발, 치료제, [키워드] 3C-like protease activities activity addition alpha-ketoamides alphacoronavirus approach Betacoronavirus boceprevir complexes coronavirus COVID-19 coxsackievirus Coxsackievirus B3 crystal structure crystal structures Crystallography enterovirus enterovirus 3C protease exhibited Glutamine HCoV HCoV-NL63 hepatitis C hepatitis C virus inhibitor lactam M pro main protease moderate NL63 optimization potency potent protease Protease inhibitor Proteases replacing repurposing resulting SARS-CoV-2 starting structure-based design Structure-based drug design telaprevir telaprevir. the SARS-CoV-2 treatments for COVID-19 Validity virus X-ray X-ray crystallography [DOI] 10.3390/molecules27134292 PMC 바로가기 [Article Type] Article
Self-derived peptides from the SARS-CoV-2 spike glycoprotein disrupting shaping and stability of the homotrimer unitSARS-CoV-2 스파이크 당단백질의 자가유래 펩타이드가 동종삼량체 단위의 형태와 안정성을 방해Article Published on 2022-07-012022-09-11 Journal: Biomedicine & pharmacotherapy = Biomédecine & phar [Category] COVID19(2023년), SARS, 변종, [키워드] approach binding binding affinity blocker blockers conformation COVID dataset destabilized develop disrupting domain exhibited functional higher affinity homotrimer host cell host cell receptor instability linear Linear motif molecular molecular dynamics monomer motif mutated Mutation opposite peptide peptides Protein protein structure RBD Region regions responsible resulting S protein S1 and S2 S1 and S2 subunit S2 subunit SARS-CoV-2 SARS-CoV-2 S Self-derived peptides shown spike spike glycoprotein stability Structural folding structure-based design subunit Support the S protein the SARS-CoV-2 Vaccine Vaccine design variant wild type β-coronavirus [DOI] 10.1016/j.biopha.2022.113190 PMC 바로가기 [Article Type] Article
Progress and Challenges in Targeting the SARS-CoV-2 Papain-like ProteaseSARS-CoV-2 파파인 유사 프로테아제 표적화의 진행 상황 및 과제Review Published on 2022-06-092022-09-11 Journal: Journal of medicinal chemistry [Category] Coronavirus, COVID19(2023년), SARS, 변종, 치료제, [키워드] addition Antiviral antiviral drug target approval approved causative agent challenge class cleavage clinic combating COVID-19 pandemic Encouraging highlight Host include inhibitor inhibitors innate immune response knowledge mechanism modulate molnupiravir Nirmatrelvir offer pandemic Papain-like protease pharmacokinetic polymerase polyprotein Progress Protease inhibitor Remdesivir Ritonavir SARS-CoV-2 structure-based design targeting the SARS-CoV-2 U.S. FDA Vaccine variant variants viral infection [DOI] 10.1021/acs.jmedchem.2c00303 PMC 바로가기 [Article Type] Review
Smaller, Stronger, More Stable: Peptide Variants of a SARS-CoV-2 Neutralizing Miniprotein더 작고, 더 강하고, 더 안정적: SARS-CoV-2 중화 미니단백질의 펩타이드 변이체Article Published on 2022-06-042022-09-11 Journal: International Journal of Molecular Sciences [Category] COVID19(2023년), MERS, SARS, 변종, 진단, [키워드] amino acids antiviral activity approach breadth characterized complex de novo Degradation dissect full-length IMPROVE incorporation miniprotein Modification Mutation neutralization Neutralizing neutralizing capacity non-proteinogenic amino acids peptide peptide mimics peptides potency protein expression proteolytic RBD Receptor binding domain Recombinant protein reported resulting retained SARS-CoV-2 SARS-CoV-2 spike protein SARS-CoV-2 variant Smaller Spike protein stability strength structure-based design susceptibility synthetic peptides the RBD the SARS-CoV-2 therapy variant virus virus variant VoC [DOI] 10.3390/ijms23116309 PMC 바로가기 [Article Type] Article
Multitarget in silico studies of Ocimum menthiifolium, family Lamiaceae against SARS-CoV-2 supported by molecular dynamics simulation분자 역학 시뮬레이션으로 지원되는 SARS-CoV-2에 대한 꿀풀과 Ocimum menthiifolium의 다중 표적 in silico 연구Article Published on 2022-06-012022-09-11 Journal: Journal of biomolecular structure & dynamics [Category] COVID19(2023년), SARS, 치료기술, 치료제, [키워드] 3CLpro acute respiratory syndrome anti-SARS-CoV-2 apigenin approved binding binding affinity binding energy binding interaction butanol can be used cause chose complex complexes Compound coronavirus COVID-2 docking results drug drugs targeting flavonoids high stability human coronavirus in silico indicated inquiry investigated M pro metabolic metabolomics molecular molecular docking molecular dynamics Molecular dynamics simulation Ocimum Ocimum menthiifolium other compound other compounds public health reported SAM SARS-CoV-1 SARS-CoV-2 Severe acute respiratory syndrome Spread stability structure-based design suggested supported targets these viruses Vaccine virulent virus [DOI] 10.1080/07391102.2020.1852964 PMC 바로가기 [Article Type] Article
Protein engineering responses to the COVID-19 pandemic코로나19 팬데믹에 대한 단백질 공학 대응Review Published on 2022-06-012022-09-11 Journal: Current opinion in structural biology [Category] COVID19(2023년), SARS, 변종, [키워드] Antigen breadth candidate COVID-19 COVID-19 pandemic COVID-19 vaccine develop display elicited glycoprotein High-resolution human population Humoral immunity nanoparticle neutralization potency other coronavirus other coronaviruses PROTECT researcher response robust SARS-CoV-2 variant SARS-CoV-2 variants Structure structure-based design Substitution vaccine candidate [DOI] 10.1016/j.sbi.2022.102385 PMC 바로가기 [Article Type] Review
Nucleic acid delivery of immune-focused SARS-CoV-2 nanoparticles drives rapid and potent immunogenicity capable of single-dose protectionArticle Published on 2022-01-112023-06-14 Journal: Cell Reports [Category] COVID19(2023년), MERS, SARS, [키워드] computational design glycans immune-focusing nanoparticle RBD SARS-CoV-2 SARS-CoV-2 challenge spike structure-based design Vaccine [DOI] 10.1016/j.celrep.2022.110318 PMC 바로가기 [Article Type] Article