Future Medicinal Chemistry

Article	Citations
10 Years Into the Resurgence of Covalent Drugs	73
De Novo Design of New Chemical Entities for SARS-CoV-2 Using Artificial Intelligence	62
N -Heterocyclic Carbene-Metal Complexes as Bio-Organometallic Antimicrobial and Anticancer Drugs, an Update (2015–2020)	60
Computational Repurposing of Benzimidazole Anthelmintic Drugs As Potential Colchicine Binding Site Inhibitors	55
HeroMDAnalysis: An Automagical Tool for GROMACS-Based Molecular Dynamics Simulation Analysis	46
The Role of microRNA-21 in the Onset and Progression of Cancer	45
Novel Carbonic Anhydrase Inhibitors	37
New Horizons in Lung Cancer Management Through ATR/CHK1 Pathway Modulation	36
PROTAC Cell Permeability and Oral Bioavailability: A Journey Into Uncharted Territory	34
Sirtuin Modulators: Past, Present, and Future Perspectives	33
Bacterial Carbonic Anhydrases: Underexploited Antibacterial Therapeutic Targets	33
Urea-functionalized Organoselenium Compounds As Promising anti-HepG2 and apoptosis-inducing Agents	32
Mechanisms of Ebselen as a Therapeutic and Its Pharmacology Applications	31
Novel N -bridged pyrazole-1-carbothioamides With Potential Antiproliferative Activity: design, synthesis, In Vitro and In S	30
Antibacterial Pyrazoles: Tackling Resistant Bacteria	29
The Role of HGF/MET in Liver Cancer	29
Melatonin Synthesis in and Uptake By Mitochondria: Implications for Diseased Cells With Dysfunctional Mitochondria	29
Novel Strategies in the War Against Antibiotic Resistance	25
Identification of a Novel Antifungal Backbone of Naphthalimide Thiazoles with Synergistic Potential for Chemical and Dynamic Treatment	25
The Promise and Current Status of CDK12/13 Inhibition for the Treatment of Cancer	25
Design of SARS-CoV-2 Mpro, PLpro Dual-Target Inhibitors Based on Deep Reinforcement Learning and Virtual Screening	25
Designing HDAC-PROTACs: Lessons Learned So Far	24
The Maturation of DNA Encoded Libraries: Opportunities for New Users	22
Kaempferol Attenuates the Effects of XIST/miR-130a/STAT3 on Inflammation and Extracellular Matrix Degradation in Osteoarthritis	22
Development of Novel Anti-Infective and Antioxidant Azole Hybrids using a Wet and Dry Approach	22

Recent Advances in Research of Colchicine Binding Site Inhibitors and Their Interaction Modes With Tubulin	21
Exploring ACSL4/LPCAT3/ALOX15 and SLC7A11/GPX4/NFE2L2 as Potential Targets in Ferroptosis-Based Cancer Therapy	20
Machine Learning and Deep Learning in Data-Driven Decision Making of Drug Discovery and Challenges in High-Quality Data Acquisition in the Pharmaceutical Industry	20
GLUT1 Biological Function and Inhibition: Research Advances	19
Antimicrobial Innovation: a Current Update and Perspective on the Antibiotic Drug Development Pipeline	19
Rutin-Loaded Liquid Crystalline Nanoparticles Attenuate Oxidative Stress in Bronchial Epithelial Cells: A PCR Validation	19
Indole Derivatives (2010–2020) As Versatile Tubulin Inhibitors: Synthesis and structure–activity Relationships	18
The Story of EGFR: From Signaling Pathways to a Potent Anticancer Target	18
Complementarity Principle in Terms of Electron Density for the Study of EGFR Complexes	18
Synthesis and Studies of Thiazolidinedione–Isatin Hybrids As α-Glucosidase Inhibitors for Management of Diabetes	18
Targeting the Bacterial SOS Response for New Antimicrobial Agents: Drug targets, Molecular Mechanisms and Inhibitors	18
Proteolysis Targeting Chimeras in Antiviral Research	17
The Urgent Need for pan-antiviral Agents: From Multitarget Discovery to Multiscale Design	17
New Evidence for Tamoxifen as an Antischistosomal Agent:In Vitro,In Vivoand Target Fishing Studies	17
Biological and Computational Investigation of Transition metal(II) Complexes of 2-phenoxyaniline-based Ligands	16
Synthesis and In Vitro Studies for Structure-Based Design of Novel Chalcones As Antitubercular Agents Targeting InhA	16
The Powerful Symbiosis Between Synthetic and Medicinal Chemistry	16
Xanthohumol Alleviates T2DM-induced Liver Steatosis and Fibrosis by Mediating the NRF2/RAGE/NF-κB Signaling Pathway	15
Research Advances in NQO1-Responsive Prodrugs and Nanocarriers for Cancer Treatment	15
The Diverse Bioactivity of α-mangostin and Its Therapeutic Implications	15
Can Natural Products Stop the SARS-CoV-2 virus? a Docking and Molecular Dynamics Study of a Natural Product Database	14
Novel Benzimidazole Derivatives as Effective Inhibitors of Prolyl Oligopeptidase: Synthesis, in Vitro and in Silico Analysis	14
Small-Molecule Inhibitors of Carboxylesterase Notum	14
Whole Blood Or Plasma: What is the Ideal Matrix for pharmacokinetic-driven Drug Candidate selection?	14
Polyhydroquinoline Derivatives for Diabetic Management: Synthesis, in Vitro and in Silico Approaches	14
Design, Synthesis and In Vitro Antiproliferation Activity of Some 2-aryl and -heteroaryl Benzoxazole Derivatives	14
New 1,3,4-thiadiazoles Derivatives: Synthesis, Antiproliferative Activity, Molecular Docking and Molecular Dynamics	13
FAK Inhibitors As Promising Anticancer Targets: Present and Future Directions	13
Curcumin-based Nanoformulations As an Emerging Therapeutic Strategy for Inflammatory Lung Diseases	13
Challenges and Opportunities for In Vivo PROTAC Delivery	13
Prevention and Treatment of Radiation-Induced Lung Injury	12
Synovial Mesenchymal Stem Cell-Derived Exosomal miR-320c Enhances Chondrogenesis By Targeting ADAM19	12
An Update on the Recent Advances and Discovery of Novel Tubulin Colchicine Binding Inhibitors	12
Development and Implementation of an enterprise-wide Predictive Model for Early absorption, distribution, Metabolism and Excretion Properties	12
Advances of Biphenyl Small-Molecule Inhibitors Targeting PD-1/PD-L1 Interaction in Cancer Immunotherapy	12
Recent Developments of RET Protein Kinase Inhibitors With Diverse Scaffolds As Hinge Binders	12
Pyrazole: an Emerging Privileged Scaffold in Drug Discovery	12
Advances in the Application of 1,2,4-Triazole-Containing Hybrids as Anti-Tuberculosis Agents	11
Green Synthesis of Nonprecious Metal-Doped Copper Hydroxide Nanoparticles for Construction of a Dopamine Sensor	11
Polyglycerol-based Hydrogels and Nanogels: From Synthesis to Applications	11
Concepts of Advanced Therapeutic Delivery Systems for the Management of Remodeling and Inflammation in Airway Diseases	11
Selection of SARS-CoV-2 Main Protease Inhibitor Using Structure-Based Virtual Screening	11
Breaker Peptides Against amyloid-β Aggregation: a Potential Therapeutic Strategy for Alzheimer’s Disease	11
The Potential Association Between PARP14 and SARS-CoV-2 Infection (COVID-19)	11
Ligand-based Design of Anticancer MMP2 Inhibitors: a Review	10
Sulfonamide-salicylaldehyde Imines Active Against methicillin- and trimethoprim/sulfonamide-resistant Staphylococci	10
Triazole-Containing Hybrids With Anti- Mycobacterium Tuberculosis Potential – Part I: 1,2,3-Triazole	10
Nanomedicine in the Treatment of Diabetic Nephropathy	10
New Theobromine Derivatives Inhibiting VEGFR-2: Design, Synthesis, Antiproliferative, Docking and Molecular Dynamics Simulations	10
Multitarget Therapeutic Approaches for Alzheimer's and Parkinson's Diseases: An Opportunity or an illusion?	10

Rapid structure-based Identification of Potential SARS-CoV-2 Main Protease Inhibitors	9
HIV-1 Capsid Inhibitors: A Sword to Destroy the Virus	9
Latest Advances in Specific Inhibition of Tumor-Associated Carbonic Anhydrases	9
E3 Ligases: a Potential Multi-Drug Target for Different Types of Cancers and Neurological Disorders	9
Leveraging Conformational Control About a Potential Atropisomeric Axis As a Strategy in Medical Chemistry	9
A Review of Current and Promising Nontuberculous Mycobacteria Antibiotics	9
‘Lights, Squaraines, Action!’ – The Role of Squaraine Dyes in Photodynamic Therapy	9
Antibacterial Properties and Carbonic Anhydrase Inhibition Profiles of Azido Sulfonyl Carbamate Derivatives	9
GANT61 Elevates Chemosensitivity to Cisplatin Through Regulating the Hedgehog, AMPK and cAMP Pathways in Ovarian Cancer	9
Mitochondrial Dysfunctions Associated With Chronic Respiratory Diseases and Their Targeted Therapies: an Update	9
Erlotinib-Containing Benzenesulfonamides As Anti- Helicobacter Pylori Agents Through Carbonic Anhydrase Inhibition	8
Identification of Known Drugs As Potential SARS-CoV-2 Mpro Inhibitors Using ligand- and Structure-Based Virtual Screening	8
Evading Antimicrobial Resistance Using boron-containing Therapeutics	8
Bacterial FtsZ Inhibition By Benzo[ d ]imidazole-2-Carboxamide Derivative With anti-TB Activity	8
Achieving Effective and Selective CK1 Inhibitors Through Structure Modification	8
Raloxifene, Identified As a Novel LSD1 Inhibitor, Suppresses the Migration of Renal Cell Carcinoma	8
A Systematic Review of carbohydrate-based Bioactive Molecules for Alzheimer’s Disease	8
Synthesis, Biochemical Evaluation and Molecular Modeling Studies of Nonpeptidic nitrile-based Fluorinated Compounds	8
Recent Approaches to mRNA Vaccine Delivery By Lipid-Based Vectors Prepared By Continuous-Flow Microfluidic Devices	8
Human Sirtuin 2 inhibitors, Their Mechanisms and Binding Modes	8
Synthesis and Activity of BNF15 Against drug-resistant Mycobacterium Tuberculosis	7
A Short Overview of Resistance to Approved Histone Deacetylase Inhibitors	7
Design and Synthesis of Novel Tacrine–Indole Hybrids As Potential Multitarget-Directed Ligands for the Treatment of Alzheimer's Disease	7
Perspectives on the Development of First-in-Class Protein Degraders	7
TSPYL2 Reduced Gefitinib Resistance and DNA Damage Repair Via Suppressing SIRT1-Mediated FOXO3 Deacetylation	7
Marine Sponge-Derived/Inspired Drugs and Their Applications in Drug Delivery Systems	7
In Silico Approaches Using Pharmacophore Model Combined With Molecular Docking for Discovery of Novel ULK1 Inhibitors	7
Structural Characteristics of Small-Molecule Inhibitors Targeting FTO Demethylase	7
Antimicrobial Peptides: Triumphs and Challenges	7
Diphenyl-Substituted Triazine Derivatives: Synthesis, α-glucosidase Inhibitory Activity, Kinetics and In Silico Studies	7
Structure Modification: a Successful Tool for Prodrug Design	7
Advances in Nonclassical Phenyl Bioisosteres for Drug Structural Optimization	7
Synthesis and Antimicrobial Activity of Thiophene-Based Heterocycles Derived from Thiophene-2-Carbohydrazide	7
Advanced Drug Delivery Systems Targeting NF-κB in Respiratory Diseases	7
Discovery of Novel 1,3,5-triazine Derivatives As an Antidiabetic Agent in Wistar Rats Via Inhibition of DPP-4	7
Design and Identification of Two Novel Resveratrol Derivatives As Potential LSD1 Inhibitors	7
Antimicrobial Potential of Quaternary Phosphonium Salt Compounds: a Review	7
1,8-Naphthyridine Derivatives: An Updated Review on Recent Advancements of Their Myriad Biological Activities	7
Synthesis, Antiviral activity, Preliminary Pharmacokinetics and Structural Parameters of Thiazolide Amine Salts	7
Small-Molecule Degraders of Cyclin-Dependent Kinase Protein: A Review	7
Recent Advances in Oxazolidinones as Antituberculosis Agents	7
Synthesis of some Tropane-Based Compounds Targeting Colon Cancer	7
Peptide Library Screening As a Tool to Derive Potent Therapeutics: Current Approaches and Future Strategies	6
Novel Xylenyl-Spaced Bis-Thiazoles/Thiazines: Synthesis, Biological Profile as Herpes Simplex Virus Type 1 Inhibitors and in Silico Simulations	6
Repurposing Dyphylline as a Pan-Coronavirus Antiviral Therapy	6
High ELK3 Expression is Associated with the VEGF-C/VEGFR-3 Axis and Gastric Tumorigenesis and Enhances Infiltration of M2 Macrophages	6
Abiotic Scaffolds in Medicinal Chemistry: Not a Waste of Chemical Space	6
Design and Synthesis of Novel Uracil-Linked Schiff Bases As Dual Histone Deacetylase Type II/topoisomerase Type I Inhibitors With Apoptotic Potential	6
Recent Progress in Small-Molecule Inhibitors for Critical Therapeutic Targets of Necroptosis	6
Novel Trypanocidal Thiophen-Chalcone Cruzain Inhibitors: Structure- and Ligand-Based Studies	6
Current Development of Pyrazole–Azole Hybrids With Anticancer Potential	6
Discovery, Biological Evaluation and Molecular Dynamic Simulations of Butyrylcholinesterase Inhibitors Through Structure-Based Pharmacophore Virtual Screening	6
Improving the Antimicrobial Activity of Old Antibacterial Drug Mafenide: Schiff Bases and Their Bioactivity Targeting Resistant Pathogens	6
Synthesis and Biological Studies of c(RGDyK) Conjugates of Cucurbitacins	6
Evolutionary Algorithm-Based Generation of Optimum Peptide Sequences with Dengue Virus Inhibitory Activity	6
Novel Pyrazoles As Potent Growth Inhibitors of Staphylococci, Enterococci and Acinetobacter Baumannii Bacteria	6
Challenging Breast Cancer Through Novel sulfonamide–pyridine Hybrids: design, synthesis, Carbonic Anhydrase IX Inhibition and Induction of Apoptosis	6
Propargylamine: an Important Moiety in Drug Discovery	6
Medicinal Applications of Coumarins Bearing Azetidinone and Thiazolidinone Moieties	6
Advances in Research With Rutin-Loaded Nanoformulations in Mitigating Lung Diseases	6
COVID-19 Screening in a Healthcare Or Community Setting: Complexity of Saliva As a Specimen for PCR-based Testing	6
Piperazine-1,2,3-triazole Scaffolds: design, synthesis, Anticancer and Antimicrobial Evaluation	5
A Novel Multi-Target Strategy to Attenuate the Progression of Parkinson's Disease by Diamine Hybrid AGE/ALE Inhibitor	5
Exploring the Putative Mechanism of Allosteric Modulations By Mixed-Action Kappa/Mu Opioid Receptor Bitopic Modulators	5
Discovery of Novel STAT3 DNA Binding Domain Inhibitors	5
α -amylase Inhibition and In Silico Studies of Novel Naphtho[2,3- d ]imidazole-4,9-Dione Linked N	5
Engineering ‘Enzymelink’ for Screening Lead Compounds to Inhibit mPGES-1 while Maintaining Prostacyclin Synthase Activity	5
Novel Set of Highly Substituted Bis-Pyridines: Synthesis, Molecular Docking and Drug-Resistant Antibacterial Profile	5
Structure-Based Virtual Screening Towards the Discovery of Novel FOXM1 Inhibitors	5
Pyrazol(in)e Derivatives of Curcumin Analogs As a New Class of Anti- Trypanosoma Cruzi Agents	5
Advancement of Targeted Protein Degradation Strategies As Therapeutics for Undruggable Disease Targets	5
Inhibitors of F 1 F 0 -ATP Synthase Enzymes for the Treatment of Tuberculosis and Cancer	5
Protein–Protein Interactions By Influenza Polymerase Subunits As Drug Targets	5
Recent Advancements in the Discovery of Cereblon-Based Protease-Targeted Chimeras With Potential for Therapeutic Intervention	5
Diaminomaleonitrile Derivatives as new Potential Antichagasic Compounds: A Study of Structure–Activity Relationships	5
Proteolysis-Targeting Chimeras in Breast Cancer Therapy	5
Combining EGFR Inhibitors With SHP2 Or LSD1 Inhibitors to Overcome Multidrug Resistance in Cancer	5
New (S)-verbenone-isoxazoline-1,3,4-thiadiazole Hybrids: Synthesis, Anticancer Activity and Apoptosis-Inducing Effect	5
Biological Activity Evaluation of Novel Monoamine Oxidase Inhibitory Compounds Targeting Parkinson Disease	5
Recent Advances of Cannabidiol Studies in Medicinal chemistry, Pharmacology and Therapeutics	5

Clinical Progress of KRAS-targeted Therapies: What next?	5
New Indole Derivatives As Multitarget anti-Alzheimer's Agents: synthesis, Biological Evaluation and Molecular Dynamics	5
Natural Products As Lead Compounds for Treatment of Neglected Tropical Diseases: Dream Or reality?	5
Histamine H 2 Receptor Radioligands: Triumphs and Challenges	5
Synthesis, Anticancer Activity, SAR and Binding Mode of Interaction Studies of Substituted Pentanoic Acids: Part II	5
Salvianolic Acid B Noncovalently Interacts With Disordered c-Myc: A Computational and Spectroscopic-Based Study	5
Novel HIF-1α Inhibitor CDMP-TQZ for Cancer Therapy	5
Synthesis, Molecular Modeling and Cholinesterase Inhibitory Effects of 2-Indolinone-Based Hydrazinecarbothioamides	5
Proteolysis-Targeting Chimera Molecules Targeting SHP2	5
Recent Advances in β-catenin/BCL9 protein–protein Interaction Inhibitors	5
Transition metal-catalyzed Synthesis of New 3-substituted Coumarin Derivatives As Antibacterial and Cytostatic Agents	5
PDE4 Inhibitors for Disease Therapy: Advances and Future Perspective	5
Design and Synthesis of Novel Pyrazolopyrimidine Candidates As Promising EGFR-T790M Inhibitors and Apoptosis Inducers	4
Design, Synthesis and Bio-Evaluation of Indolin-2-Ones As Potential Antidiabetic Agents	4
Identification of Dual-Targeted Mycobacterium Tuberculosis Aminoacyl-tRNA Synthetase Inhibitors Using Machine Learning	4
Cationic Polysaccharides: Emerging Drug Delivery Vehicle Across the Physiological Mucus Barrier	4
Synthesis and Antimalarial Activity of 7-Chloroquinoline-Tethered Sulfonamides and Their [1,2,3]-Triazole Hybrids	4
Development and Investigation of Thiazolidinedione and Pyrazoline Compounds As Antiangiogenic Weapons Targeting VEGFR-2	4
Structure-Based Molecular Insights Into Matrix Metalloproteinase Inhibitors in Cancer Treatments	4
HDAC8 As an Emerging Target in Drug Discovery With Special Emphasis on Medicinal Chemistry	4
Exploitation of a Novel Allosteric Binding Region in DNA Gyrase and its Implications for Antibacterial Drug Discovery	4
Medicinal Chemistry Approaches for the Discovery of Plasmodium Falciparum Dihydroorotate Dehydrogenase Inhibitors as Antimalarial Agents	4
Benzo[ d ]thiazole-2-Carboxamides As New Antituberculosis Chemotypes Inhibiting Mycobacterial ATP Phosphoribosyl Transferase	4
CK1 Delta Inhibition: An Emerging Strategy to Combat Neurodegenerative Diseases	4
Kaempferol Ameliorates the Regulatory Effects of PVT1 / miR-214 on Epithelial–Mesenchymal Transition Through the PAK4/β-catenin Axis in SR	4
ISMN-Loaded PLGA-PEG Nanoparticles Conjugated with Anti- Staphylococcus Aureus α-Toxin Inhibit Staphylococcus Aureus Biofilms in Chronic R	4
Tetrahydroquinoline: An Efficient Scaffold As mTOR Inhibitor for the Treatment of Lung Cancer	4
A Hybrid Resampling Algorithms SMOTE and ENN Based Deep Learning Models for Identification of Marburg Virus Inhibitors	4
Recent Advances in ATM Inhibitors As Potential Therapeutic Agents	4
Investigation of Halogenated Furanones As Inhibitors of Quorum sensing-regulated Bioluminescence in Vibrio Harveyi	4
Synthesis of New Hantzsch Adducts Showing Ca 2+ Channel Blockade capacity, Cholinesterase Inhibition and Antioxidant Power	4
Mitigating Inflammation Using Advanced Drug Delivery By Targeting TNF-α in Lung Diseases	4
4-Adamantyl-(2-(arylidene)hydrazinyl)thiazoles As Potential Antidiabetic Agents: Experimental and Docking Studies	4
Application of a Fluorescent H 2 S Probe Based on Excited-State Intramolecular Proton Transfer for Detecting Latent Mechanism of H 2	4
Targeting Mucin Hypersecretion in COVID-19 Therapy	4
New Small Molecule Fluorescent Probes for G protein-coupled Receptors: Valuable Tools for Drug Discovery	4
Synthetic Corticosteroids As Tryptophan Hydroxylase Stabilizers	4
Pyrazoline Scaffold: Hit Identification to Lead Synthesis and Biological Evaluation As Antidiabetic Agents	4
Chemical Language Models for Applications in Medicinal Chemistry	4
Latest Progress in the Development of Multitarget Ligands for Alzheimer's Disease Based on the Hantzsch Reaction	4
Discovery of New thieno[2,3- d ]pyrimidines as EGFR Tyrosine Kinase Inhibitors for Cancer Treatment	4
Versatile Tools of Synthetic Biology Applied to Drug Discovery and Production	4
Dorzolamide Suppresses PKCδ -TIRAP-p38 MAPK Signaling Axis to Dampen the Inflammatory Response	4
Cyclin-Dependent Kinases As Potential Targets for Colorectal Cancer: Past, Present and Future	4
Candesartan, Losartan and Valsartan Zn(II) Complexes Interactions With Bovine Serum Albumin	4
Novel Azole–Sulfonamide Conjugates as Potential Antimicrobial Candidates: Synthesis and Biological Assessment	4
Zinc Complexation Improves Angiotensin II Receptor Type 1 Blockade and In Vivo Antihypertensive Activity of Telmisartan	4
Can Dextran-Based Nanoparticles Mitigate Inflammatory Lung diseases?	4
Carbenoxolone Disodium Suppresses the Migration of Gastric Cancer By Targeting HDAC6	4
New Coumarin Derivatives Accessible in Short and Eco-Friendly Conditions with Antifungal Activity	4
Selective CDK9 Degradation Using a Proteolysis-Targeting Chimera (PROTAC) Strategy	4
Combining Structure-Based and 3D QSAR Pharmacophore Models to Discover Diverse Ligands Against EGFR in Oral Cancer	4
Resistant Starch: Ideal Candidate for the Enteric Coating of NSAIDs?	4
Search for New Therapeutics Against HIV-1 Via Dual Inhibition of RNase H and Integrase: Current Status and Future Challenges	4
Recent Advances in Quinolone Hybrids With Potential Antibacterial Activity Against drug-resistant Bacteria	4
Design, Synthesis and Exploration of Novel Triazinoindoles as Potent Quorum-Sensing Inhibitors and Radical Quenchers	4
5,7,3′,4′-Tetramethoxyflavone Ameliorates Cholesterol Dysregulation by Mediating SIRT1/FOXO3a/ABCA1 Signaling in Osteoarthritis Chondrocytes	4
Click Synthesis, Antimicrobial, DNA Photocleavage and Computational Studies of Oxindole-Tethered 1 H -1,2,3-triazoles	4
Functional Characterization of HIC, a P2Y1 agonist, As a p53 Stabilizer for Prostate Cancer Cell Death Induction	4
Synthesis of Indole-Substituted Thiosemicarbazones as an Aldose Reductase Inhibitor: An In Vitro , Selectivity and In Silico Study	4
Targeting Bacterial Biofilms With persister-killing Agents	4
Glyco Disulfide Capped Gold Nanoparticle Synthesis: Cytotoxicity Studies and Effects on Lung Cancer A549 Cells	3
Major Structure–Activity Relationships of Resolvins, Protectins, Maresins and Their Analogues	3
Design, Synthesis, Biological Evaluation and Docking Study of Novel Quinazoline Derivatives As EGFR-TK Inhibitors	3
Computational Insights Into Novel Inhibitor Indole-Heterocycle Specific Against Glycogen Phosphorylase Isoenzymes Interaction Mechanism	3
Identification of Sulfonamide-Based Butyrylcholinesterase Inhibitors Using Machine Learning	3
Discovery of 1,5-diaryl-1,2,4-triazole Derivatives as Myoferlin Inhibitors and Their Antitumor Effects in Pancreatic Cancer	3
Citrate Transporter Inhibitors: Possible New Anticancer Agents	3
Recent Progress of Palmitoyl Transferase DHHC3 As a Novel Antitumor Target	3
Advances in the Development of Connexin Hemichannel Inhibitors Selective Toward Cx43	3
Discovery of Novel PRMT5 Inhibitors Bearing a Methylpiperazinyl Moiety	3
Design, Synthesis and Evaluation of Novel Phenanthridine Triazole Analogs as Potential Antileishmanial Agents	3
Virtual Screening Identifies Tipranavir As a SIRT1 Inhibitor With anti-hepatocarcinoma Effect	3
Inherent Efficacies of Pyrazole-Based Derivatives for Cancer Therapy: The Interface Between Experiment and In Silico	3
G-quadruplex Ligands As Therapeutic Agents Against cancer, Neurological Disorders and Viral Infections	3
Inhibiting the Metallo-β-lactamases: Challenges and Strategies to Overcome Bacterial β-lactam Resistance	3
Antimicrobial, Anticancer and Immunomodulatory Potential of New Quinazolines Bearing Benzenesulfonamide Moiety	3
Multicomponent Reactions As a Privileged Tool for Multitarget-Directed Ligand Strategies in Alzheimer’s Disease Therapy	3
Development of Small Macrocyclic Kinase Inhibitors	3
Application of Iron Oxide Nanoparticles to Control the Release of Minocycline for the Treatment of Glioblastoma	3
Design, Synthesis and Cytotoxic Evaluation of Peptoid Analogs of an Anticancer Active Triazolylpeptidyl Penicillin	3
Efficient One-Pot Synthesis of Arylated Pyrazole-Fused Pyran Analogs: As Leads to Treating Diabetes and Alzheimer's Disease	3
Discovery of Novel and Potent InhA Inhibitors By an In Silico Screening and Pharmacokinetic Prediction	3
Aminopyridone-Linked Benzimidazoles: A Fragment-Based Drug Design for the Development of CDK9 Inhibitors	3
Inhibition of α-glucosidase Enzyme By ‘click'-inspired Pharmacophore Framework 1,3,4-thiadiazole–1,2,3-triazole Hybrids	3
Hitting Drug-Resistant Malaria Infection With Triazole-Linked Flavonoid–Chloroquine Hybrid Compounds	3
Restoration of p53 Functions By Suppression of mortalin–p53 Sequestration: an Emerging Target in Cancer Therapy	3
Super-Conserved Receptors Expressed in the Brain: Biology and Medicinal Chemistry Efforts	3
Synthesis and Molecular Modeling Studies of 1-Benzyl-2-Indolinones As Selective AChE Inhibitors	3
PPARγ Transcription Effect on Naturally Occurring O -Prenyl Cinnamaldehydes and Cinnamyl Alcohol Derivatives	3
The Structural Basis of Effective LOX-1 Inhibition	3
Explainable Machine Learning for Medicinal Chemistry: Exploring Multi-Target Compounds	3
Design, Synthesis and Antitumor Activity of Novel pyran-functionalized Uracil Derivatives: Docking Studies	3
Hydrazone–Sulfonate Hybrids as Potential Cholinesterase Inhibitors: Design, Synthesis and Molecular Modeling Simulation	3
Development and In Vivo Evaluation of Fused Benzazole Analogs of Anti-Melanoma Agent HA15	3