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Items: 1 to 20 of 53

1.

In Vitro Antidiabetic, Anti-Obesity and Antioxidant Analysis of Ocimum basilicum Aerial Biomass and in Silico Molecular Docking Simulations with Alpha-Amylase and Lipase Enzymes.

Noor ZI, Ahmed D, Rehman HM, Qamar MT, Froeyen M, Ahmad S, Mirza MU.

Biology (Basel). 2019 Dec 4;8(4). pii: E92. doi: 10.3390/biology8040092.

PMID:
31817095
2.

Deleterious Variants in WNT10A, EDAR, and EDA Causing Isolated and Syndromic Tooth Agenesis: A Structural Perspective from Molecular Dynamics Simulations.

Parveen A, Khan SA, Mirza MU, Bashir H, Arshad F, Iqbal M, Ahmad W, Wahab A, Fiaz A, Naz S, Ashraf F, Mobeen T, Aziz S, Ahmed SS, Muhammad N, Hassib NF, Mostafa MI, Gaboon NE, Gul R, Khan S, Froeyen M, Shoaib M, Wasif N.

Int J Mol Sci. 2019 Oct 24;20(21). pii: E5282. doi: 10.3390/ijms20215282.

PMID:
31652981
3.

A novel pathogenic missense variant in CNNM4 underlying Jalili syndrome: Insights from molecular dynamics simulations.

Parveen A, Mirza MU, Vanmeert M, Akhtar J, Bashir H, Khan S, Shehzad S, Froeyen M, Ahmed W, Ansar M, Wasif N.

Mol Genet Genomic Med. 2019 Sep;7(9):e902. doi: 10.1002/mgg3.902. Epub 2019 Jul 25.

PMID:
31347285
4.

Bioassay Directed Isolation, Biological Evaluation and in Silico Studies of New Isolates from Pteris cretica L.

Saleem F, Mehmood R, Mehar S, Khan MTJ, Khan ZU, Ashraf M, Ali MS, Abdullah I, Froeyen M, Mirza MU, Ahmad S.

Antioxidants (Basel). 2019 Jul 19;8(7). pii: E231. doi: 10.3390/antiox8070231.

PMID:
31331076
5.

Quantification of Berberine in Berberis vulgaris L. Root Extract and Its Curative and Prophylactic Role in Cisplatin-Induced In Vivo Toxicity and In Vitro Cytotoxicity.

Ahmad S, Hussain A, Hussain A, Abdullah I, Ali MS, Froeyen M, Mirza MU.

Antioxidants (Basel). 2019 Jun 19;8(6). pii: E185. doi: 10.3390/antiox8060185.

PMID:
31248160
6.

In silico structural elucidation of RNA-dependent RNA polymerase towards the identification of potential Crimean-Congo Hemorrhagic Fever Virus inhibitors.

Mirza MU, Vanmeert M, Froeyen M, Ali A, Rafique S, Idrees M.

Sci Rep. 2019 May 2;9(1):6809. doi: 10.1038/s41598-019-43129-2.

PMID:
31048746
7.

Mutagenesis of DsbAss is Crucial for the Signal Recognition Particle Mechanism in Escherichia coli: Insights from Molecular Dynamics Simulations.

Durrani FG, Gul R, Mirza MU, Kaderbhai NN, Froeyen M, Saleem M.

Biomolecules. 2019 Apr 3;9(4). pii: E133. doi: 10.3390/biom9040133.

PMID:
30987187
8.

Inhibition of Oncogenic Kinases: An In Vitro Validated Computational Approach Identified Potential Multi-Target Anticancer Compounds.

Ikram N, Mirza MU, Vanmeert M, Froeyen M, Salo-Ahen OMH, Tahir M, Qazi A, Ahmad S.

Biomolecules. 2019 Mar 28;9(4). pii: E124. doi: 10.3390/biom9040124.

PMID:
30925835
9.

In vitro evaluation of arylsubstituted imidazoles derivatives as antiprotozoal agents and docking studies on sterol 14α-demethylase (CYP51) from Trypanosoma cruzi, Leishmania infantum, and Trypanosoma brucei.

Rojas Vargas JA, López AG, Pérez Y, Cos P, Froeyen M.

Parasitol Res. 2019 May;118(5):1533-1548. doi: 10.1007/s00436-019-06206-z. Epub 2019 Mar 23.

PMID:
30903349
10.

Perspectives towards antiviral drug discovery against Ebola virus.

Mirza MU, Vanmeert M, Ali A, Iman K, Froeyen M, Idrees M.

J Med Virol. 2019 Dec;91(12):2029-2048. doi: 10.1002/jmv.25357. Epub 2019 Sep 30. Review.

PMID:
30431654
11.

Methylated Nucleobases: Synthesis and Evaluation for Base Pairing In Vitro and In Vivo.

Jabgunde AM, Jaziri F, Bande O, Froeyen M, Abramov M, Nguyen H, Schepers G, Lescrinier E, Pinheiro VB, Pezo V, Marlière P, Herdewijn P.

Chemistry. 2018 Aug 27;24(48):12695-12707. doi: 10.1002/chem.201802304. Epub 2018 Jul 23.

PMID:
29883012
12.

Family-wide analysis of aminoacyl-sulfamoyl-3-deazaadenosine analogues as inhibitors of aminoacyl-tRNA synthetases.

Zhang B, De Graef S, Nautiyal M, Pang L, Gadakh B, Froeyen M, Van Mellaert L, Strelkov SV, Weeks SD, Van Aerschot A.

Eur J Med Chem. 2018 Mar 25;148:384-396. doi: 10.1016/j.ejmech.2018.02.013. Epub 2018 Feb 14.

PMID:
29477072
13.

Corrigenda to "Elaboration of a proprietary thymidylate kinase inhibitor motif towards anti-tuberculosis agents" [Bioorg Med Chem 24 (2016) 5172-5182].

Song L, Risseeuw MDP, Froeyen M, Karalic I, Goeman J, Cappoen D, Van der Eycken J, Cos P, Munier-Lehmann H, Van Calenbergh S.

Bioorg Med Chem. 2017 Oct 15;25(20):5889. doi: 10.1016/j.bmc.2017.08.023. Epub 2017 Aug 18. No abstract available.

PMID:
28826595
14.

Elaboration of a proprietary thymidylate kinase inhibitor motif towards anti-tuberculosis agents.

Song L, Risseeuw MDP, Froeyen M, Karalic I, Goeman J, Cappoen D, Van der Eycken J, Cos P, Munier-Lehmann H, Van Calenbergh S.

Bioorg Med Chem. 2016 Nov 1;24(21):5172-5182. doi: 10.1016/j.bmc.2016.08.041. Epub 2016 Aug 24. Erratum in: Bioorg Med Chem. 2017 Oct 15;25(20):5889.

PMID:
27614917
15.

Molecular simulation of cyclohexanyl nucleic acid (CNA) duplexes with CNA, DNA and RNA and CNA triloop and tetraloop hairpin structures.

Froeyen M, Abu el Asrar R, Abramov M, Herdewijn P.

Bioorg Med Chem. 2016 Apr 15;24(8):1778-85. doi: 10.1016/j.bmc.2016.03.007. Epub 2016 Mar 3.

PMID:
26968651
16.

Circular trimers of gelatinase B/matrix metalloproteinase-9 constitute a distinct population of functional enzyme molecules differentially regulated by tissue inhibitor of metalloproteinases-1.

Vandooren J, Born B, Solomonov I, Zajac E, Saldova R, Senske M, Ugarte-Berzal E, Martens E, Van den Steen PE, Van Damme J, Garcia-Pardo A, Froeyen M, Deryugina EI, Quigley JP, Moestrup SK, Rudd PM, Sagi I, Opdenakker G.

Biochem J. 2015 Jan 15;465(2):259-70. doi: 10.1042/BJ20140418.

PMID:
25360794
17.

Discovery of an acyclic nucleoside phosphonate that inhibits Mycobacterium tuberculosis ThyX based on the binding mode of a 5-alkynyl substrate analogue.

Parchina A, Froeyen M, Margamuljana L, Rozenski J, De Jonghe S, Briers Y, Lavigne R, Herdewijn P, Lescrinier E.

ChemMedChem. 2013 Aug;8(8):1373-83. doi: 10.1002/cmdc.201300146. Epub 2013 Jul 8.

PMID:
23836539
18.

Enantiomeric selection properties of β-homoDNA: enhanced pairing for heterochiral complexes.

D'Alonzo D, Amato J, Schepers G, Froeyen M, Van Aerschot A, Herdewijn P, Guaragna A.

Angew Chem Int Ed Engl. 2013 Jun 24;52(26):6662-5. doi: 10.1002/anie.201301659. Epub 2013 May 13. No abstract available.

PMID:
23670912
19.

Thermodynamic computational approach to capture molecular recognition in the binding of different inhibitors to the DNA gyrase B subunit from Escherichia coli.

Saíz-Urra L, Pérez MÁ, Froeyen M.

J Mol Model. 2013 Aug;19(8):3187-200. doi: 10.1007/s00894-013-1849-1. Epub 2013 Apr 30.

PMID:
23625033
20.

Synthesis and inhibitory activity of thymidine analogues targeting Mycobacterium tuberculosis thymidine monophosphate kinase.

Van Poecke S, Munier-Lehmann H, Helynck O, Froeyen M, Van Calenbergh S.

Bioorg Med Chem. 2011 Dec 15;19(24):7603-11. doi: 10.1016/j.bmc.2011.10.021. Epub 2011 Oct 18.

PMID:
22061826

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