Evidence map›Paper›PMID 30986947›Full record

ArticleMolecules (Basel, Switzerland)2019

Synthesis, In Silico, and In Vitro Evaluation of Anti-Leishmanial Activity of Oxadiazoles and Indolizine Containing Compounds Flagged against Anti-Targets.

Strahinja Stevanovic, Milan Sencanski, Mathieu Danel, Christophe Menendez, Roumaissa Belguedj, Abdelmalek Bouraiou, Katarina Nikolic, Sandrine Cojean, Philippe M Loiseau, Sanja Glisic and 2 more

Open access · goldAbstract read
In one paragraph

Article in Molecules (Basel, Switzerland), 2019. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 6 papers.

0numbers the graph read from it
0cells of the map it votes in
6citing papers in PubMed
2.4field-weighted citation impact, top 12% of its field
1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

6 citing papers in PubMed, 21 citations in OpenAlex.

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4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

12 authors at 5 institutions in 4 countries.

Strahinja StevanovicLaboratory for Bioinformatics and Computational Chemistry, Institute of Nuclear Sciences VINCA, University of Belgrade, P.O. Box 522, 11001 Belgrade, Serbia. strahinja.stevanovic@protonmail.com.
Milan SencanskiLaboratory for Bioinformatics and Computational Chemistry, Institute of Nuclear Sciences VINCA, University of Belgrade, P.O. Box 522, 11001 Belgrade, Serbia. sencanski@vin.bg.ac.rs.
Mathieu DanelITAV, Université de Toulouse, CNRS, 31062 Toulouse, France. mathieu.danel@itav.fr.ORCID 0000-0003-0122-8990
Christophe MenendezDepartment of Chemistry, Université de Toulouse, UPS, CNRS UMR 5068, LSPCMIB, 118 Route de Narbonne, 31062 Toulouse, France. menendez@chimie.ups-tlse.fr.
Roumaissa BelguedjDepartment of Chemistry, Université de Toulouse, UPS, CNRS UMR 5068, LSPCMIB, 118 Route de Narbonne, 31062 Toulouse, France. racha_belg@hotmail.fr.
Abdelmalek BouraiouUnité de Recherche de Chimie de l'Environnement et Moléculaire Structurale, Université Frères Mentouri, Route de Ain El Bey, 25000 Constantine, Algeria. bouraiou.abdelmalek@yahoo.fr.
Katarina NikolicDepartment of Pharmaceutical Chemistry, Faculty of Pharmacy, University of Belgrade, Vojvode Stepe 450, 11000 Belgrade, Serbia. knikolic@pharmacy.bg.ac.rs.ORCID 0000-0002-3656-9245
Sandrine CojeanAntiparasitic Chemotherapy, UMR 8076 CNRS BioCIS, Faculty of Pharmacy Université Paris-Sud, Rue Jean-Baptiste Clément, F 92290 Chatenay-Malabry, France. sandrine.cojean@u-psud.fr.
Philippe M LoiseauAntiparasitic Chemotherapy, UMR 8076 CNRS BioCIS, Faculty of Pharmacy Université Paris-Sud, Rue Jean-Baptiste Clément, F 92290 Chatenay-Malabry, France. philippe.loiseau@u-psud.fr.
Sanja GlisicLaboratory for Bioinformatics and Computational Chemistry, Institute of Nuclear Sciences VINCA, University of Belgrade, P.O. Box 522, 11001 Belgrade, Serbia. sanja@vin.bg.ac.rs.ORCID 0000-0001-5691-1055
Michel BaltasDepartment of Chemistry, Université de Toulouse, UPS, CNRS UMR 5068, LSPCMIB, 118 Route de Narbonne, 31062 Toulouse, France. baltas@chimie.ups-tlse.fr.
Alfonso T García-SosaInstitute of Chemistry, University of Tartu, Ravila 14a, 50411 Tartu, Estonia. alfonsog@ut.ee.ORCID 0000-0003-0542-4446
University of Belgrade · RSCentre National de la Recherche Scientifique · FRUniversité Paris-Sud · FRUniversity Frères Mentouri Constantine 1 · DZUniversity of Tartu · EE

Funding

Haridus- ja Teadusministeerium IUT34-14Ministarstvo Prosvete, Nauke i Tehnološkog Razvoja 173001
6 · The paper itself

Abstract

Due to the lack of approved vaccines against human leishmaniasis and the limitations of the current chemotherapy inducing side effects and drug resistance, development of new, effective chemotherapeutic agents is essential. This study describes the synthesis of a series of novel oxadiazoles and indolizine-containing compounds. The compounds were screened in silico using an EIIP/AQVN filter followed by ligand-based virtual screening and molecular docking to parasite arginase. Top hits were further screened versus human arginase and finally against an anti-target battery to tag their possible interactions with proteins essential for the metabolism and clearance of many substances. Eight candidate compounds were selected for further experimental testing. The results show measurable in vitro anti-leishmanial activity for three compounds. One compound with an IC

Indexed as

AnimalsAntiprotozoal AgentsArginaseIndolizinesLeishmania donovaniMiceMolecular Docking SimulationMolecular StructureOxadiazolesRAW 264.7 CellsAntiprotozoal AgentsArginaseindolizineIndolizinesOxadiazolesanti-leishmanial inhibitorsanti-targetarginasein silicoin vitroLeishmania

Identifiers

PMID30986947
PMCPMC6480966
OpenAlexW2927624929

What OpenQuestion holds

Textmetadata
LicenceCC BY
Read underepoch 390

Registered trials

None linked

Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.