<HashMap><database>biostudies-literature</database><scores/><additional><omics_type>Unknown</omics_type><volume>16(3)</volume><submitter>Sakyi PO</submitter><pubmed_abstract>The recent outlook of leishmaniasis as a global public health concern coupled with the reportage of resistance and lack of efficacy of most antileishmanial drugs calls for a concerted effort to find new leads. The study combined &lt;i>In silico&lt;/i> and in vitro approaches to identify novel potential synthetic small-molecule inhibitors targeting the &lt;i>Leishmania donovani&lt;/i> sterol methyltransferase (&lt;i>Ld&lt;/i>SMT). The &lt;i>Ld&lt;/i>SMT enzyme in the ergosterol biosynthetic pathway is required for the parasite's membrane fluidity, distribution of membrane proteins, and control of the cell cycle. The lack of &lt;i>Ld&lt;/i>SMT homologue in the human host and its conserved nature among all &lt;i>Leishmania&lt;/i> parasites makes it a viable target for future antileishmanial drugs. Initially, six known inhibitor</pubmed_abstract><journal>Pharmaceuticals (Basel, Switzerland)</journal><pagination>330</pagination><full_dataset_link>https://www.ebi.ac.uk/biostudies/studies/S-EPMC10054574</full_dataset_link><repository>biostudies-literature</repository><pubmed_title>Inhibiting &lt;i>Leishmania donovani&lt;/i> Sterol Methyltransferase to Identify Lead Compounds Using Molecular Modelling.</pubmed_title><pmcid>PMC10054574</pmcid><pubmed_authors>Miller WA</pubmed_authors><pubmed_authors>Wilson MD</pubmed_authors><pubmed_authors>Tuekpe JK</pubmed_authors><pubmed_authors>Kwofie SK</pubmed_authors><pubmed_authors>Gwira TM</pubmed_authors><pubmed_authors>Broni E</pubmed_authors><pubmed_authors>Amewu RK</pubmed_authors><pubmed_authors>Sakyi PO</pubmed_authors></additional><is_claimable>false</is_claimable><name>Inhibiting &lt;i>Leishmania donovani&lt;/i> Sterol Methyltransferase to Identify Lead Compounds Using Molecular Modelling.</name><description>The recent outlook of leishmaniasis as a global public health concern coupled with the reportage of resistance and lack of efficacy of most antileishmanial drugs calls for a concerted effort to find new leads. The study combined &lt;i>In silico&lt;/i> and in vitro approaches to identify novel potential synthetic small-molecule inhibitors targeting the &lt;i>Leishmania donovani&lt;/i> sterol methyltransferase (&lt;i>Ld&lt;/i>SMT). The &lt;i>Ld&lt;/i>SMT enzyme in the ergosterol biosynthetic pathway is required for the parasite's membrane fluidity, distribution of membrane proteins, and control of the cell cycle. The lack of &lt;i>Ld&lt;/i>SMT homologue in the human host and its conserved nature among all &lt;i>Leishmania&lt;/i> parasites makes it a viable target for future antileishmanial drugs. Initially, six known inhibitor</description><dates><release>2023-01-01T00:00:00Z</release><publication>2023 Feb</publication><modification>2025-04-22T18:22:10.011Z</modification><creation>2025-02-19T01:13:26.982Z</creation></dates><accession>S-EPMC10054574</accession><cross_references><pubmed>36986430</pubmed><doi>10.3390/ph16030330</doi></cross_references></HashMap>