In silico methods for identification of potential active sites of therapeutic targets

J Liao, Q Wang, F Wu, Z Huang - Molecules, 2022 - mdpi.com
Target identification is an important step in drug discovery, and computer-aided drug target
identification methods are attracting more attention compared with traditional drug target …

Integrated computational approaches and tools for allosteric drug discovery

O Sheik Amamuddy, W Veldman, C Manyumwa… - International journal of …, 2020 - mdpi.com
Understanding molecular mechanisms underlying the complexity of allosteric regulation in
proteins has attracted considerable attention in drug discovery due to the benefits and …

Targeting aminoacyl tRNA synthetases for antimalarial drug development

SC Xie, MDW Griffin, EA Winzeler… - Annual Review of …, 2023 - annualreviews.org
Infections caused by malaria parasites place an enormous burden on the world's poorest
communities. Breakthrough drugs with novel mechanisms of action are urgently needed. As …

Cytoplasmic isoleucyl tRNA synthetase as an attractive multistage antimalarial drug target

ES Istvan, F Guerra, M Abraham, KS Huang… - Science translational …, 2023 - science.org
Development of antimalarial compounds into clinical candidates remains costly and arduous
without detailed knowledge of the target. As resistance increases and treatment options at …

Advances in malaria pharmacology and the online guide to MALARIA PHARMACOLOGY: IUPHAR review 38

JF Armstrong, B Campo, SPH Alexander… - British Journal of …, 2023 - Wiley Online Library
Antimalarial drug discovery has until recently been driven by high‐throughput phenotypic
cellular screening, allowing millions of compounds to be assayed and delivering clinical …

SANCDB: an update on South African natural compounds and their readily available analogs

BN Diallo, M Glenister, TM Musyoka, K Lobb… - Journal of …, 2021 - Springer
Abstract Background South African Natural Compounds Database (SANCDB; https://sancdb.
rubi. ru. ac. za/) is the sole and a fully referenced database of natural chemical compounds …

[HTML][HTML] The antimalarial resistome–finding new drug targets and their modes of action

K Carolino, EA Winzeler - Current opinion in microbiology, 2020 - Elsevier
Highlights•In-vitro evolution and whole genome sequencing elucidates gene–drug
interactions.•Cellular thermal shift assay and mass spectrometry directly reveals small …

Novel chloroquine loaded curcumin based anionic linear globular dendrimer G2: A metabolomics study on Plasmodium falciparum in vitro using 1H NMR …

T Elmi, MS Ardestani, F Hajialiani, M Motevalian… - Parasitology, 2020 - cambridge.org
Due to side-effects and inefficiency of the drugs used in malaria treatment, finding alternative
medicine with less side-effects has attracted much attention. In this regard, in the present …

Genome‐wide study of glutathione transferases and their regulation in flufenacet susceptible and resistant black‐grass (Alopecurus myosuroides Huds.)

E Parcharidou, R Dücker, R Beffa - Pest Management Science, 2024 - Wiley Online Library
BACKGROUND Glutathione transferases (GSTs) are enzymes with a wide range of
functions, including herbicide detoxification. Up‐regulation of GSTs and their detoxification …

Structural analyses of the malaria parasite aminoacyl‐tRNA synthetases provide new avenues for antimalarial drug discovery

J Chhibber‐Goel, M Yogavel, A Sharma - Protein Science, 2021 - Wiley Online Library
Malaria is a parasitic illness caused by the genus Plasmodium from the apicomplexan
phylum. Five plasmodial species of P. falciparum (Pf), P. knowlesi, P. malariae, P. ovale, and …