Cheminformatic Profiling and Hit Prioritization of Natural Products with Activities against Methicillin-Resistant

Anti-Bacterial Agents / pharmacology Anti-Infective Agents / pharmacology Biological Products / chemistry Cheminformatics / methods Databases, Factual Drug Evaluation, Preclinical / methods Methicillin-Resistant Staphylococcus aureus / drug effects Microbial Sensitivity Tests Staphylococcus aureus / drug effects Structure-Activity Relationship
cheminformatics desirability score drug-likeness hit-to-lead optimization methicillin-resistant Staphylococcus aureus (MRSA), hit prioritization natural products profiling

Journal

Molecules (Basel, Switzerland)
ISSN: 1420-3049
Titre abrégé: Molecules
Pays: Switzerland
ID NLM: 100964009

Informations de publication

Date de publication:
16 Jun 2021
Historique:
received: 15 03 2021
revised: 28 04 2021
accepted: 08 05 2021
entrez: 2 7 2021
pubmed: 3 7 2021
medline: 14 7 2021
Statut: epublish

Résumé

Several natural products (NPs) have displayed varying in vitro activities against methicillin-resistant

Identifiants

DOI: 10.3390/molecules26123674 PMID: 34208597 PMC: PMC8246317
pubmed: 34208597
pii: molecules26123674
doi: 10.3390/molecules26123674
pmc: PMC8246317
pii:
doi:

Substances chimiques

Anti-Bacterial Agents 0
Anti-Infective Agents 0
Biological Products 0

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Références

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Auteurs

Samson O Oselusi (SO)

School of Pharmacy, University of the Western Cape, Bellville, Cape Town 7535, South Africa.
ORCID: 0000-0003-4736-0823

Samuel A Egieyeh (SA)

School of Pharmacy, University of the Western Cape, Bellville, Cape Town 7535, South Africa.
ORCID: 0000-0002-7462-6669

Alan Christoffels (A)

South African Medical Research Council Bioinformatics Unit, South African National Bioinformatics Institute, University of the Western Cape, Cape Town 7535, South Africa.
ORCID: 0000-0002-0420-2916

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Classifications MeSH

questionsmedicales.fr › Actions chimiques et utilisations › Actions pharmacologiques › Utilisations thérapeutiques › Anti-infectieux › Antibactériens › Cheminformatic Profiling and Hit...
questionsmedicales.fr › Actions chimiques et utilisations › Actions pharmacologiques › Utilisations thérapeutiques › Anti-infectieux › Cheminformatic Profiling and Hit...
questionsmedicales.fr › Mélanges complexes › Produits biologiques › Cheminformatic Profiling and Hit...
questionsmedicales.fr › Sciences de l'information › Informatique › Chimio-informatique › Cheminformatic Profiling and Hit...
questionsmedicales.fr › Sciences de l'information › Mémorisation et recherche des informations › Bases de données comme sujet › Bases de données factuelles › Cheminformatic Profiling and Hit...
questionsmedicales.fr › Techniques d'investigation › Évaluation préclinique de médicament › Cheminformatic Profiling and Hit...
questionsmedicales.fr › Bactéries › Bactéries à Gram positif › Cocci à Gram positif › Staphylococcaceae › Staphylococcus › Staphylococcus aureus › Staphylococcus aureus résistant à la méticilline › Cheminformatic Profiling and Hit...
questionsmedicales.fr › Techniques d'investigation › Évaluation préclinique de médicament › Tests de sensibilité microbienne › Cheminformatic Profiling and Hit...
questionsmedicales.fr › Bactéries › Bactéries à Gram positif › Cocci à Gram positif › Staphylococcaceae › Staphylococcus › Staphylococcus aureus › Cheminformatic Profiling and Hit...
questionsmedicales.fr › Phénomènes physiologiques › Phénomènes pharmacologiques et toxicologiques › Phénomènes pharmacologiques › Relation structure-activité › Cheminformatic Profiling and Hit...