Search Results - "Soliman, Mahmoud E"

Unveiling therapeutic frontiers: DON/DRP-104 as innovative Plasma kallikrein inhibitors against carcinoma-associated hereditary angioedema shocks - a comprehensive molecular dynamics exploration by Oduro-Kwateng, Ernest, Soliman, Mahmoud E. S.

“…Human plasma kallikrein (PKa) is a member of the serine protease family and serves as a key mediator of the kallikrein-kinin system (KKS), which is known for…”
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Covalent Versus Non-covalent Enzyme Inhibition: Which Route Should We Take? A Justification of the Good and Bad from Molecular Modelling Perspective by Aljoundi, Aimen, Bjij, Imane, El Rashedy, Ahmed, Soliman, Mahmoud E. S.

“…The pace and efficiency of drug target strategies have been emanating debates among researchers in the field of drug development. Covalent inhibitors possess…”
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Structural Insights into the Role of Pseudouridimycin Binding in Disruption of Bacterial RNA Polymerase Bridge Helix Conformational Arrangement by H Rabbad, Ali, Agoni, Clement, E Soliman, Mahmoud

“…The bridge helix (BH) is a crucial region in bacterial RNA polymerase (RNAP) catalysis. It plays an essential role in the nucleotide addition cycle (NAC) by…”
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Antibiotic resistance: bioinformatics-based understanding as a functional strategy for drug design by Ndagi, Umar, Falaki, Abubakar A, Abdullahi, Maryam, Lawal, Monsurat M, Soliman, Mahmoud E

“…The use of antibiotics to manage infectious diseases dates back to ancient civilization, but the lack of a clear distinction between the therapeutic and toxic…”
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Integrated Approach to Structure-Based Enzymatic Drug Design: Molecular Modeling, Spectroscopy, and Experimental Bioactivity by Honarparvar, Bahareh, Govender, Thavendran, Maguire, Glenn E. M, Soliman, Mahmoud E. S, Kruger, Hendrik G

“…An integrated approach to designing structure-based enzymatic drugs is detailed, focusing on molecular modeling, experimental bioactivity and biophysical…”
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An Update on the Pharmacological Usage of Curcumin: Has it Failed in the Drug Discovery Pipeline? by Olotu, Fisayo, Agoni, Clement, Soremekun, Opeyemi, Soliman, Mahmoud E. S.

“…The pharmacological propensities of curcumin have been reported in a plethora of pre-clinical and clinical studies. However, innate attributes account for…”
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Unravelling the Structural Mechanism of Action of 5-methyl-5-[4-(4-oxo-3H-quinazolin-2-yl)phenyl]imidazolidine-2,4-dione in Dual-Targeting Tankyrase 1 and 2: A Novel Avenue in Cancer Therapy by Peters, Xylia Q., Agoni, Clement, Soliman, Mahmoud E. S.

“…Tankyrase (TNKS) belonging to the poly(ADPribose) polymerase family, are known for their multi-functioning capabilities, and play an essential role in the Wnt…”
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Multi-catalytic Sites Inhibition of Bcl2 Induces Expanding of Hydrophobic Groove: A New Avenue Towards Waldenström Macroglobulinemia Therapy by Elamin, Ghazi, Aljoundi, Aimen, Soliman, Mahmoud E. S.

“…B-cell lymphoma 2 (Bcl2) is a key protein regulator of apoptosis. The hydrophobic groove in Bcl2 is a unique structural feature to this class of enzymes and…”
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Bridging the Gap in Malaria Parasite Resistance, Current Interventions, and the Way Forward from in Silico Perspective: A Review by Kumi, Ransford Oduro, Oti, Belinda, Abo-Dya, Nader E, Alahmdi, Mohamed Issa, Soliman, Mahmoud E S

“…The past decade has seen most antimalarial drugs lose their clinical potency stemming from parasite resistance. Despite immense efforts by researchers to…”
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Targeting HCV polymerase: a structural and dynamic perspective into the mechanism of selective covalent inhibition by Shunmugam, Letitia, Soliman, Mahmoud E. S

“…Background : Concerns have been raised over the emerging pandemic status of hepatitis C virus (HCV). Current available drugs lack specificity, stability and…”
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Probing the Highly Disparate Dual Inhibitory Mechanisms of Novel Quinazoline Derivatives against Mycobacterium tuberculosis Protein Kinases A and B by Olotu, Fisayo A, Soliman, Mahmoud E

“…( ) serine/threonine (Ser/Thr) Protein kinases A (PknA) and B (PknB) have been identified as highly attractive targets for overcoming drug resistant…”
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Pharmacophore-Based 3D-QSAR Analysis of Thienyl Chalcones as a New Class of Human MAO‑B Inhibitors: Investigation of Combined Quantum Chemical and Molecular Dynamics Approach by Mathew, Bijo, Adeniyi, Adebayo A, Dev, Sanal, Joy, Monu, Ucar, Gülberk, Mathew, Githa Elizabeth, Singh-Pillay, Ashona, Soliman, Mahmoud E. S

“…Selective monoamine oxidase-B (MAO-B) inhibitors are imperative in the treatment of various neurodegenerative disorders. Herein, we describe the pharmacophore…”
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Talazoparib Dual-targeting on Poly (ADP-ribose) Polymerase-1 and -16 Enzymes Offers a Promising Therapeutic Strategy in Small Cell Lung Cancer Therapy: Insight from Biophysical Computations by Mgoboza, Chwayita, Okunlola, Felix O., Akawa, Oluwole B., Aljoundi, Aimen, Soliman, Mahmoud E. S.

“…In recent times, inhibition of poly (ADP-ribose) polymerase (PARP) enzymes by pharmacological drugs has attracted much attention as an anticancer therapy. As…”
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Selective SIRT2 inhibitors as promising anticancer therapeutics: An update from 2016 to 2020 by Roshdy, Eslam, Mustafa, Muhamad, Shaltout, Abd El-Rahman, Radwan, Mohamed O., Ibrahim, Mahmoud A.A., Soliman, Mahmoud E., Fujita, Mikako, Otsuka, Masami, Ali, Taha F.S.

“…Sirtuin 2 (SIRT2) is a member of the human sirtuins, which regulates various biological processes and is deemed as a novel biomarker for different cancers…”
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Probing Alterations in MDM2 Catalytic Core Structure Effect of Garcinia Mangostana Derivatives: Insight from Molecular Dynamics Simulations by El habbash, Aisha I., Aljoundi, Aimen, Elamin, Ghazi, Soliman, Mahmoud E. S.

“…The MDM2–p53 protein–protein interaction is a promising model for researchers to design, study, and discover new anticancer drugs. The design of…”
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Glioma-Targeted Therapeutics: Computer-Aided Drug Design Prospective by Poonan, Preantha, Agoni, Clement, Ibrahim, Mahmoud A. A., Soliman, Mahmoud E. S.

“…Amongst the several types of brain cancers known to humankind, glioma is one of the most severe and life-threatening types of cancer, comprising 40% of all…”
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Thompson loop: opportunities for antitubercular drug design by targeting the weak spot in demethylmenaquinone methyltransferase protein by Adewumi, Adeniyi T, Soremekun, Opeyemi S, Ajadi, Mary B, Soliman, Mahmoud E. S

“…Drug-resistant Tuberculosis (TB) has remained the top global health challenge, with a yearly estimation of 10 million infections and 1.5 million deaths in…”
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A Mechanistic Probe into the Dual Inhibition of T. cruzi Glucokinase and Hexokinase in Chagas Disease Treatment – A Stone Killing Two Birds? by Omolabi, Kehinde F., Odeniran, Paul O., Olotu, Fisayo A., S. Soliman, Mahmoud E.

“…Glucokinase (GLK) and Hexokinase (HK) have been characterized as essential targets in Trypanosoma cruzi (Tc)‐mediated infection. A recent study reported the…”
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Piece of the puzzle: Remdesivir disassembles the multimeric SARS-CoV-2 RNA-dependent RNA polymerase complex by Olotu, Fisayo A., Omolabi, Kehinde F., Soliman, Mahmoud E. S.

“…The recently emerged SARS-like coronavirus (SARS-CoV-2) has continued to spread rapidly among humans with alarming upsurges in global mortality rates. A major…”
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Sesamol Loaded Albumin Nanoparticles: A Boosted Protective Property in Animal Models of Oxidative Stress by Zaher, Sara, Soliman, Mahmoud E., Elsabahy, Mahmoud, Hathout, Rania M.

“…The current study evaluated the ability of sesamol-loaded albumin nanoparticles to impart protection against oxidative stress induced by anthracyclines in…”
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