Future Medicinal Chemistry

Article	Citations
Biological and computational evaluation of novel benzofuranyl derivatives as acetylcholinesterase and butyrylcholinesterase inhibitors	57
Targeting Tuberculosis – An Interview With Robert Abramovitch	51
Identification of Sulfonamide-Based Butyrylcholinesterase Inhibitors Using Machine Learning	46
In vivo evaluation of novel synthetic pyrazolones as CDK9 inhibitors with enhanced pharmacokinetic properties	45
The Connection Between PARP14 and SARS-CoV-2	45
Citrate Transporter Inhibitors: Possible New Anticancer Agents	37
A Review of Current and Promising Nontuberculous Mycobacteria Antibiotics	37
Therapeutic N -Heterocyclic Carbenes: An Interview With Alejandro Bugarin	37
Combining EGFR Inhibitors With SHP2 Or LSD1 Inhibitors to Overcome Multidrug Resistance in Cancer	37
PPARγ Transcription Effect on Naturally Occurring O -Prenyl Cinnamaldehydes and Cinnamyl Alcohol Derivatives	33
Sulfonamide-salicylaldehyde Imines Active Against methicillin- and trimethoprim/sulfonamide-resistant Staphylococci	32
Investigations of New N 1 -Substituted Pyrazoles as Anti-Inflammatory and Analgesic Agents having COX Inhibitory Act	31
Selection of SARS-CoV-2 Main Protease Inhibitor Using Structure-Based Virtual Screening	29
Design of SARS-CoV-2 Mpro, PLpro Dual-Target Inhibitors Based on Deep Reinforcement Learning and Virtual Screening	28
Design and synthesis of new nicotinamides as immunomodulatory VEGFR-2 inhibitors and apoptosis inducers	27
Super-Conserved Receptors Expressed in the Brain: Biology and Medicinal Chemistry Efforts	27
Novel Set of Highly Substituted Bis-Pyridines: Synthesis, Molecular Docking and Drug-Resistant Antibacterial Profile	26
Combining Structure-Based and 3D QSAR Pharmacophore Models to Discover Diverse Ligands Against EGFR in Oral Cancer	26
Development of 5-hydroxybenzothiophene derivatives as multi-kinase inhibitors with potential anti-cancer activity	26
Advances in AR-Targeting Chimeras: A Case Study of proteolysis-targeting Chimeras From Bench to Bedside	24
New pyrrolopyridine-based Thiazolotriazoles As Diabetics Inhibitors: Enzymatic Kinetics and In Silico Study	22
A New Class of 5-HT 1A Receptor Antagonists With Procognitive and Antidepressant Properties	21
Basic nitrogen (BaN): a ‘privileged element’ in medicinal chemistry	21
Discovery of Novel Covalent Inhibitors of DJ-1 Through Hybrid Virtual Screening	19
5,7,3′,4′-Tetramethoxyflavone Ameliorates Cholesterol Dysregulation by Mediating SIRT1/FOXO3a/ABCA1 Signaling in Osteoarthritis Chondrocytes	19

Synthesis of Hydrazinyl–Thiazole Ester Derivatives, in Vitro Trypanocidal and Leishmanicidal Activities	19
Diaminomaleonitrile Derivatives as new Potential Antichagasic Compounds: A Study of Structure–Activity Relationships	19
Rh(III) and Ru(II) Complexes With Phosphanyl–Alkylamines: Inhibition of DNA Synthesis Induced By Anticancer Rh Complex	18
Synergistic effect of new pyrimidine derivative with oxacilin against methicillin-resistant Staphylococcus aureus	18
Barbiturate–sulfonate hybrids as potent cholinesterase inhibitors: design, synthesis and molecular modeling studies	18
Propargylamine: an Important Moiety in Drug Discovery	18
Synthesis, in vitro and in silico anticancer evaluation of novel pyridin-2-yl estra-1,3,5(10)-triene derivatives	17
Computational Insights Into Novel Inhibitor Indole-Heterocycle Specific Against Glycogen Phosphorylase Isoenzymes Interaction Mechanism	16
HDAC8 As an Emerging Target in Drug Discovery With Special Emphasis on Medicinal Chemistry	16
Novel Xylenyl-Spaced Bis-Thiazoles/Thiazines: Synthesis, Biological Profile as Herpes Simplex Virus Type 1 Inhibitors and in Silico Simulations	16
Design, synthesis and inhibition evaluation of novel chalcone amide α-glucosidase inhibitors	16
Keto-Bridged Dual Triazole-Linked Benzenesulfonamides As Potent Carbonic Anhydrase and Cathepsin B Inhibitors	15
Medicinal Chemistry in Big Pharma has a Gender Diversity Problem	15
Machine Learning and Deep Learning in Data-Driven Decision Making of Drug Discovery and Challenges in High-Quality Data Acquisition in the Pharmaceutical Industry	15
Copper(II) complexes of 2-hydroxy-1-naphthaldehyde Schiff bases: synthesis, in vitro activity and computational studies	14
Unlocking the power of imidazoquinolines: recent advances in anticancer and immunotherapeutic strategies	14
Recent Advancements in the Discovery of Cereblon-Based Protease-Targeted Chimeras With Potential for Therapeutic Intervention	14
HIV-1 Capsid Inhibitors: A Sword to Destroy the Virus	13
Management of Adenocarcinoma With Honokiol: Progress So Far and the Way Forward	13
Targeting TGF-β: Triumphs and Challenges	13
GANT61 Elevates Chemosensitivity to Cisplatin Through Regulating the Hedgehog, AMPK and cAMP Pathways in Ovarian Cancer	13
γ-Secretase As a Drug Target for Familial Alzheimer's Disease: The Road Less Traveled	13
Potent α-glucosidase inhibitors with benzimidazole-propionitrile hybridization; synthesis, bioassay and docking study	13
Computational Repurposing of Benzimidazole Anthelmintic Drugs As Potential Colchicine Binding Site Inhibitors	13
Synthesis of indole-functionalized isoniazid conjugates with potent antimycobacterial and antioxidant efficacy	13
Autophagy degradation: a promising dimension in drug discovery for neurodegenerative diseases	12
Design, Synthesis and Antitumor Activity of Novel pyran-functionalized Uracil Derivatives: Docking Studies	12
The versatility of phenothiazines as an anticancer drug scaffold	12
How does machine learning augment alchemical binding free energy calculations?	12
Novel bis-benzimidazole-triazole hybrids: anticancer study, in silico approaches, and mechanistic investigation	12
Treating Neurodegenerative Diseases with Multitarget Drugs: An Interview With Maria João Matos	12
Rapid structure-based Identification of Potential SARS-CoV-2 Main Protease Inhibitors	12
Piperazine-1,2,3-triazole Scaffolds: design, synthesis, Anticancer and Antimicrobial Evaluation	12
Palbociclib-derived multifunctional molecules for lysosomal targeting and diagnostic-therapeutic integration	12
Novel Effective Small-Molecule Inhibitors of Protein Kinases Related to Tau Pathology in Alzheimer's Disease	11
Proteolysis Targeting Chimeras in Antiviral Research	11
Explainable Machine Learning for Medicinal Chemistry: Exploring Multi-Target Compounds	11
Synthesis of Novel Furan-Based Chalcone Derivatives As Anti-Tuberculosis Agents: In Vitro , Cytotoxicity Assessment and In Silico	11
E3 Ligases: a Potential Multi-Drug Target for Different Types of Cancers and Neurological Disorders	11
Synovial Mesenchymal Stem Cell-Derived Exosomal miR-320c Enhances Chondrogenesis By Targeting ADAM19	11
NeuroClick: Software for Mimicking Click Reaction to Generate Drug-Like Molecules Permeating the Blood–Brain Barrier	10
Synthesis and Characterization of Potent RIPK3 Inhibitors Based on a Tricyclic Scaffold	10
Design, Synthesis and Bio-Evaluation of Indolin-2-Ones As Potential Antidiabetic Agents	10
Refinement of MEK inhibitors	10
Design, Synthesis and Biological Evaluation of Novel Selective PI3Kδ Inhibitors Containing Pyridopyrimidine Scaffold	10
Selenium: The Emerging Element in the Medicinal Chemist’s Toolkit	10
Levamisole Derivatives As Immune Modulators for the Treatment of Amyotrophic Lateral Sclerosis (ALS)	10
In vitro anti-breast cancer study of hybrid cinnamic acid derivatives bearing 2-thiohydantoin moiety	10
Targeted small molecule therapy and inhibitors for lymphoma	10
Advances of Biphenyl Small-Molecule Inhibitors Targeting PD-1/PD-L1 Interaction in Cancer Immunotherapy	10

Novel 2-Indolinone Derivatives as Promising Agents against Respiratory Syncytial and Yellow Fever Viruses	10
19 Schiff Bases as Antimycobacterial Agents: Synthesis, Molecular Docking and a Plausible Mechanism of Action	9
New Theobromine Derivatives Inhibiting VEGFR-2: Design, Synthesis, Antiproliferative, Docking and Molecular Dynamics Simulations	9
Novel Carbonic Anhydrase Inhibitors	9
One-pot synthesis and pharmacological evaluation of new quinoline/pyrimido-diazepines as pulmonary antifibrotic agents	9
Transition metal complexes: next-generation photosensitizers for combating Gram-positive bacteria	9
Novel Benzochromenes: Design, Synthesis, Cytotoxicity, Molecular Docking and Mechanistic Investigations	9
New Indole Derivatives As Multitarget anti-Alzheimer's Agents: synthesis, Biological Evaluation and Molecular Dynamics	9
Candesartan, Losartan and Valsartan Zn(II) Complexes Interactions With Bovine Serum Albumin	8
Dorzolamide Suppresses PKCδ -TIRAP-p38 MAPK Signaling Axis to Dampen the Inflammatory Response	8
Novel Diamides Inspired By Protein Kinase Inhibitors As Anti- Trypanosoma Cruzi Agents: In Vitro and In Vivo	8
From clove oil to bioactive agents: synthetic routes, antimicrobial and antiparasitic activities of eugenol derivatives	8
Mucin Glycosylation: A Potential Target for Prostate Cancer Management	8
BioPrint Meets the AI Age: Development of Artificial Intelligence-Based ADMET Models for the Drug-Discovery Platform SAFIRE	8
Clinical Progress of KRAS-targeted Therapies: What next?	8
Thiazolidinedione–Triazole Conjugates: Design, Synthesis and Probing of the α-Amylase Inhibitory Potential	8
Advancement of Targeted Protein Degradation Strategies As Therapeutics for Undruggable Disease Targets	7
Kynomycin: A Beacon of Hope in the Battle Against Antibiotic Resistance	7
Synthesis of Hydrazinylthiazole Carboxylates: A Mechanistic Approach for Treatment of Diabetes and Its Complications	7
The anticancer therapeutic potential of pyrimidine–sulfonamide hybrids	7
Synthesis and antiproliferative evaluation of novel 3,5,8-trisubstituted coumarins against breast cancer	7
COVID-19 Diagnostic Assay Sensitivity: Lessons for the Upcoming Wave Or Next Pandemic	7
Design, synthesis and mechanistic exploration of anti-plasmodial Indolo[2,3- b ]quinoxaline-7-chloroquinoline hybrids	7
New thiazolidin-4-ones as anti-cervical cancer agents targeting EGFR: design, synthesis, and computational studies	7
Recent Advances of Cannabidiol Studies in Medicinal chemistry, Pharmacology and Therapeutics	7
Development of indole hybrids for potential lung cancer treatment-part I: nitrogen-containing six-membered aromatic heterocycles	7
Ultrasonic-assisted synthesis and antitumor evaluation of novel variant heterocyclic compounds based on piperidine ring	7
Proteolysis-Targeting Chimera Molecules Targeting SHP2	7
Molecular Glues Targeting Protein Degradation Pathways for Drug Discovery	7
Organoselenium compounds beyond antioxidants	7
Novel Pyrimidine-1,3,4-Oxadiazole Hybrids and Their Precursors As Potential Antimycobacterial Agents	7
In-vitro and in-silico assessment of thiazole-thiazolidinone derivatives as selective inhibitors of urease and α-glucosidase	7
Welcome to the 16th Volume of Future Medicinal Chemistry	7
Design and Identification of Two Novel Resveratrol Derivatives As Potential LSD1 Inhibitors	7
The emerging field of senotherapeutic drugs	6
Network Analysis and Ligand-Based Pharmacophore Modeling for Discovery of Small Molecule Against Glioblastoma Multiforme	6
Dual VEGFR-2 and EGFR T790M inhibitors of phenyldiazenes: anticancer evaluations, ADMET, docking, design and synthesis	6
Novel coumarin linked pyrazoles, thiazoles, and thiadiazoles: synthetic strategies and in vitro antimicrobial investigation	6
Virtual and Augmented Reality Applications in Medicinal Chemistry	6
The antibreast cancer therapeutic potential of quinazoline hybrids–Part I	6
Cyclin-Dependent Kinases As Potential Targets for Colorectal Cancer: Past, Present and Future	6
Research Progress on Tamoxifen and Its Analogs Associated With Nuclear Receptors	6
CK1 Delta Inhibition: An Emerging Strategy to Combat Neurodegenerative Diseases	6
Design and Synthesis of Selective FLT3 Inhibitors Via Exploration of Back Pocket II	6
Evidence-based drug discovery	6
Antimicrobial, Anticancer and Immunomodulatory Potential of New Quinazolines Bearing Benzenesulfonamide Moiety	6
Design, Synthesis and Anticancer Evaluation of Some Novel 7-Hydroxy-4-Methyl-3-Substituted Benzopyran-2-One Derivatives	6
Pyrazine-based small molecule kinase inhibitors: clinical applications and patent review (2019–2023)	6
Novel 4-Aminoquinoline Analogs Targeting the HIF-1α Signaling Pathway	6
Benzimidazole-acrylonitrile hybrid derivatives act as potent urease inhibitors with possible fungicidal activity	6
Optimizing selective estrogen receptor degraders for anticancer drug development	6
Corrigendum	6
Synthesis, characterization and biological evaluation of aurones as potential neuroprotective agents	6
Development of Small Macrocyclic Kinase Inhibitors	6
Establishment of Models for Reliability Evaluation of 3CLpro Ligand-Receptor Complexes With Different Binding Sites	6
Design, semi-synthesis and bioevaluation of koumine-like derivatives as potential antitumor agents in vitro and in vivo	5
Design and Synthesis of Novel Aza-Ursolic Acid Derivatives: In Vitro Cytotoxicity and Nitric Oxide Release Inhibitory Activity	5
Recent development of azole–sulfonamide hybrids with the anticancer potential	5
Our New Year's (re)solution: Welcome to the 15th Volume of Future Medicinal Chemistry	5
Unveiling the potential of HS-1793: a review of its anticancer properties and therapeutic promise	5
Designing molecular hybrids as novel breast cancer therapeutics	5
Human Sirtuin 2 inhibitors, Their Mechanisms and Binding Modes	5
Expanding potential of quinoline hydrazide/hydrazone derivatives as anticancer agents	5
Innovative virtual screening of PD-L1 inhibitors: the synergy of molecular similarity, neural networks and GNINA docking	5
Resistant Starch: Ideal Candidate for the Enteric Coating of NSAIDs?	5
Synthesis, cytotoxicity and 99m Tc-MIBI tumor cell uptake evaluation of 2-phenylbenzothiazole tagged triazole derivatives	5
Design, Synthesis and Structure–Activity Relationship Studies of Novel Spirochromanone Hydrochloride Analogs As Anticancer Agents	5
Development of indole hybrids for potential lung cancer treatment - part II	5
Semicarbazone, thiosemicarbazone tailed isoxazoline-pyrazole: synthesis, DFT, biological and computational assessment	5
Enoxacin-Based Derivatives: Antimicrobial and Antibiofilm Agent: A Biology-Oriented Drug Synthesis (BIODS) Approach	5
A novel class of potent antiangiogenic and antioxidant pyrazoles: synthesis, bioactivity, docking and ADMET studies	5
Therapeutic targeting of neuroinflammation in methamphetamine use disorder	5
Salvianolic Acid B Noncovalently Interacts With Disordered c-Myc: A Computational and Spectroscopic-Based Study	5
Synthesis and Anti-Ovarian Cancer Effects of Benzimidazole-2-Substituted Pyridine and Phenyl Propenone Derivatives	5
Tetrahydroquinoline: An Efficient Scaffold As mTOR Inhibitor for the Treatment of Lung Cancer	5
Glyco Disulfide Capped Gold Nanoparticle Synthesis: Cytotoxicity Studies and Effects on Lung Cancer A549 Cells	5
Sirtuin Modulators: Past, Present, and Future Perspectives	5
Prioritizing oral bioavailability in drug development strategies	5
Parasitic Sirtuin 2 As an Opportunity in Drug Discovery	5
Targeting STK33: From Inhibition to Degradation	5

Challenging Breast Cancer Through Novel sulfonamide–pyridine Hybrids: design, synthesis, Carbonic Anhydrase IX Inhibition and Induction of Apoptosis	5
Key developments in fluorinated heterocycles	5
Benzo[ d ]thiazole-2-Carboxamides As New Antituberculosis Chemotypes Inhibiting Mycobacterial ATP Phosphoribosyl Transferase	5
Therapeutic potential of chalcone-1,2,3-triazole hybrids as anti-tumour agents: a systematic review and SAR studies	5
Gold: Not Just jewelry…	5
Combining Virtual Screening and In Vitro Evaluation for the Discovery of Potential CYP11B2 Inhibitors	5