Medicinal Chemistry Research

Article	Citations
Synthesis of the dibenzylbutane lignan LCA derivatives and evaluation of their anti-inflammatory activities	94
Acetylcholinesterase inhibition, molecular docking and ADME prediction studies of new dihydrofuran-piperazine hybrid compounds	92
Monoamine oxidase inhibition by thiazole derivatives substituted with the benzenesulfonamide moiety	68
Computer-aided design, synthesis and evaluation of new SARS-CoV-2 Mpro inhibitors based on 1,5,6,7-tetrahydro-4H-indazol-4-one scaffold	54
Novel imino-thiazoloquinoxaline derivatives against renal cell carcinoma: less radiation-damaging approach	51
Synthesis, characterization and in vitro antitumor activity of asiatic acid derivatives	46
Structural simplification and ester bond flipping lead to bis-benzodioxole derivatives as potential hypolipidemic and hepatoprotective agent	44
Carbamoyl flavonoids as dual inhibitors of acetylcholinesterase and monoacylglycerol lipase: synthesis, in vitro evaluation, and computational studies	37
Synthesis and biological evaluation of (20S,24R)-epoxy-dammarane-3β,12β,25-triol derivatives as α-glucosidase and PTP1B inhibitors	36
Design, synthesis and anti-breast cancer properties of butyric ester tethered dihydroartemisinin-isatin hybrids	35
Targeting cAMP signaling and phosphodiesterase 4 for liver disease treatment	35
Synthesis and antitumor activity evaluation in vitro of 4-aminoquinazoline derivatives containing 1,3,4-thiadiazole	34
Glutathione and glutathione disulfide – their biomedical and pharmaceutical applications	32
Antibacterial, antifungal activities and toxicity of new synthetic fatty acid salicylate esters	31
Asciminib: first FDA approved allosteric inhibitor of BCR-ABL1 for the treatment of chronic myeloid leukemia	31
Design, synthesis, and antitumor activity evaluation of carbazole derivatives with potent HDAC inhibitory activity	30
Evaluation of a series of nucleoside analogs as effective anticoronaviral-2 drugs against the Omicron-B.1.1.529/BA.2 subvariant: A repurposing research study	30
Ellagic acid (EA), a tannin was isolated from Eucalyptus citriodora leaves and its anti-inflammatory activity	30
Bio-guided isolation of anti-Alzheimer’s compounds from Phyllanthus niruri and role of niruriflavone in the reversal of aluminum chloride-induced neurobehavioral and biochemical changes in an animal m	30
Synthesis of berberine derivatives and their antiviral activity toward respiratory syncytial virus	29
Synthesis of tetrahydro-β-carboline analogs with N11 modifications and study of their antimalarial activities	28
Potent α-glucosidase inhibitory activity of inoscavin A from fruiting bodies of Fulvifomes fastuosus: Mechanism of action, molecular docking and ADMET	28
Screening of small molecule compounds targeting hnRNPA2 protein	28
Synthesis of novel benzothieno-[3,2’-f][1,3] oxazepines and their isomeric 2-oxo-2H-spiro[benzothiophene-3,3’-pyrrolines] via 1,4-dipolar cycloaddition reaction and their evaluation as cytotoxic antic	28
Pyrrolo[2,1-f][1,2,4]triazine: a promising fused heterocycle to target kinases in cancer therapy	27

Inhibition of protein kinases by proton pump inhibitors: computational screening and in vitro evaluation	25
Medicinal uses, phytochemistry, pharmacology, and taxonomy of Poygonum aviculare L.: a comprehensive review	25
Recent advances in triazole-benzenesulfonamide hybrids and their biological activities	24
Synthesis, crystal structure, and anticancer activity of organotin(IV) complexes based on chlorine substituted aryl ligands	24
Contrasting effect of different crowding agents on pseudoknot RNA stability	23
Design and synthesis of diphenyl-1H-imidazole analogs targeting Mpro/3CLpro enzyme of SARS-CoV-2	21
Evaluation of benzoylacetonitriles as novel anti-neuroinflammatory agents	21
Synthesis, inhibition effects, molecular docking and theoretical studies as Paraoxonase 1 (PON1) inhibitors of novel 1,4-dihydropyridine substituted sulfonamide derivatives	21
Enantioselectivity of pinene against Leishmania amazonensis	21
A versatile strategy for the synthesis of various lumazine peptides	21
Utilizing mechanistic organic chemistry training to study drug metabolism in preclinical drug discovery/development	20
Synthesis of nitrogen-containing oleanolic acid derivatives as carbonic anhydrase and acetylcholinesterase inhibitors	19
Semi-synthesis and cytotoxicity evaluation of pyrimidine, thiazole, and indole analogues of argentatins A–C from guayule (Parthenium argentatum) resin	19
Synthesis and potential antimicrobial activity of novel α-aminophosphonates derivatives bearing substituted quinoline or quinolone and thiazole moieties	18
Design, Synthesis, and biological evaluation of pyrazolo-benzothiazole derivatives as a potential therapeutic agent for the treatment of Alzheimer’s disease	18
Pyrrolobenzodiazepines: natural sources, therapeutic uses, and future in neurological treatments	18
Synthesis and biological evaluation of esculetin derivatives as potential anti-HBV agents	17
Development of new donepezil analogs: synthesis, biological screening and in silico study rational	16
α-Glucosidase inhibitory activities of aromatic compounds from the rhizomes of Alpinia galanga	16
Design, synthesis and evaluation of salicylic acid-donepezil hybrids as functional agents for the treatment of Alzheimer’s disease	16
Novel indanone-chalcone esters with potential anti-Alzheimer effects designed using hybridization and bioisosteric replacement approaches	16
A Click Synthesis, Molecular Docking and Biological Evaluation of 1,2,3-triazoles-benzoxazepine hybrid as potential anticancer agents	16
Exploring thiazole-linked thioureas using alkaline phosphatase assay, biochemical evaluation, computational analysis and structure–activity relationship (SAR) studies	15
Novel conjugated 5-alkenyl rhodanine tethered 1,4-benzodioxane derivatives as dual-chitinases inhibitors to hinder the growth of Asian corn borer	15
Role of natural secondary metabolites as HIF-1 inhibitors in cancer therapy	15
Synthetic studies toward a simplified eleuthoside core	15
Synthesis, bacteria activity and molecular simulation of D-galactose-conjugated thiosemicarbazones of 3-aryl-4-formylsydnones	15
Polyketides from Neohelicosporium griseum: structure assignment and bioactivity investigation	15
A vitamin D C/D ring-derived compound with cytotoxicity	15
Pks 13 inhibitors—a promising target for future antitubercular agents	14
Dual-PROTACs based on natural product derivative potassium dehydrographolide succinate: design, synthesis, and antitumor activity of a novel EGFR degrader	14
Design and synthesis of potential fungicidal compounds derived from natural products, (-)-menthol and (-)-borneol	14
1,2,3-triazenes and 1,2,3-triazoles as antileishmanial, antitrypanosomal, and antiplasmodial agents	14
Antitumor studies on celastrol and its derivatives as RORα agonists and RORγ inhibitors based on Alphafold reverse docking strategy	14
The metabolic fate of izencitinib, a gut-selective pan-JAK inhibitor, in humans. Identification of unusual fecal metabolites and implications for MIST evaluation	14
In silico design of antimicrobial oligopeptides based on 3D-QSAR modeling and bioassay evaluation	14
Synthesis, characterization, and anticancer activity of syringaldehyde-derived chalcones against female cancers	13
Synthesis and biological assessment of triazolo-quinazoline carbothioamide derivatives for p38 MAP kinase inhibition: in-silico and in-vitro approaches	13
Antivirulence therapy: type IV pilus as a druggable target for bacterial infections	13
A potent therapeutic scaffold fusing quinazolinone/melatonin for future colorectal cancer interventions: design, one-pot synthesis, biological and ADME-tox modeling studies	13
Design, synthesis, and evaluation of functionalized 5-(4-arylpiperazin-1-yl)-N-arylpentanamides as selective dopamine D3 receptor ligands	13
Molecular hybridization method for obtaining paeonol-based fibrate derivatives with potent lipid-lowering and hepatoprotective activity	13
Design, synthesis and antitumor activity evaluation of 2,4,6-trisubstituted quinazoline derivatives containing piperidine moiety	13
Insights on synthetic strategies and structure-activity relationship of donepezil and its derivatives	12
Synthesis and biological evaluation of coumarin derivatives as anti-lung adenocarcinoma agents via induction of apoptosis and autophagy: in vitro and in vivo studies	12
Design, synthesis and evaluation of aurone and indanone derivatives as novel antitumor agents	12
Synthesis and pharmacological evaluation of new disulfides linked to 1,2,4-triazole bearing urea moiety	12
Synthesis, antiviral evaluation, molecular docking study and cytotoxicity of 5′-phosphorylated 1,2,3-triazolyl nucleoside analogues with thymine and 6-methyl uracil moieties	12
Biological evaluation of imidazopyridine derivatives as potential anticancer agents against breast cancer cells	12
Antiproliferative effect, cell cycle arrest and apoptosis generation of novel 6-substituted N5-formyltetrahydropyrido[3,2-d]pyrimidine derivatives	12

Rehmannia glutinosa polysaccharides: a review on structure-activity relationship and biological activity	12
Glycyrrhizin and its derivatives: an emerging secondary metabolite arsenal of Glycyrrhiza glabra	12
Novel 2-aminopyrimidine Schiff bases as possible GABA-AT inhibitors: molecular docking, MAOS, and pharmacological screening	12
Discovery of potent maternal embryonic leucine zipper kinase (MELK) inhibitors of novel chemotypes using structure-based pharmacophores	12
Assessment of the α-glucosidase and α-amylase inhibitory potential of Paliurus spina-christi Mill. and its terpenic compounds	11
Synthesis, antiproliferative, and antimicrobial properties of novel phthalimide derivatives	11
Discovery of novel HCV inhibitors: design, synthesis and biological activity of phthalamide derivatives	11
Synthesis and effects of ginkgolides and ginkgolide B derivatives on platelet activating factor induced platelet aggregation in rabbits	11
Polyalthia longifolia: phytochemistry, ethnomedicinal importance, nutritive value, and pharmacological activities review	11
Pharmacological assessment of disulfide–triazine hybrids: synthesis, enzyme inhibition, and molecular docking study	10
Structure related α-glucosidase inhibitory activity and molecular docking analyses of phenolic compounds from Paeonia suffruticosa	10
Isatin-linked 4,4-dimethyl-5-methylene-4,5-dihydrothiazole-2-thiols for inhibition of acetylcholinesterase	10
Design, synthesis and molecular docking studies of novel benzimidazole-1,3,4-oxadiazole hybrids for their carbonic anhydrase inhibitory and antioxidant effects	10
Correction to: Identification and evaluation of natural organosulfur compounds as potential dual inhibitors of α-amylase and α-glucosidase activity: an in-silico and in-vitro approach	10
Discovery of α-methylene-γ-lactone-δ-epoxy derivatives with anti-cancer activity: synthesis, SAR study, and biological activity	10
Kaempferia diterpenoids and flavonoids: an overview on phytochemistry, biosynthesis, synthesis, pharmacology, and pharmacokinetics	9
Synthesis, in vitro activity, and molecular docking of caffeic acid and resveratrol derivatives against Alzheimer’s disease-related enzymes	9
Discovery of novel pterostilbene/biphenyl tethered 5-FU based conjugates targeting colorectal cancer: synthesis, cytotoxic and ADMET modeling studies	9
Discovery of mobocertinib, a new irreversible tyrosine kinase inhibitor indicated for the treatment of non-small-cell lung cancer harboring EGFR exon 20 insertion mutations	9
An insight into prodrug strategy for the treatment of Alzheimer’s disease	9
CYP3A4 drug metabolism considerations in pediatric pharmacotherapy	9
Synthesis and in vitro biological activity of chalcone derivatives as potential antiparasitic agents	9
4,5-diazafenylfluorene-rhodanine conjugates promote anoikis in A375 cells via inhibiting PPAR-γ expression	8
Sesquiterpene lactones isolated from Carpesium abrotanoides L. by LC–MS combined with HSCCC inhibit liver cancer through suppression of the JAK2/STAT3 signaling pathway	8
Synthesis of functionalized 5-(4-arylpiperazin-1-yl)-N-arylpentanamides and their evaluation as D3 receptor ligands	8
Synthesis and inhibitory activity against enzymes responsible for Type 2 diabetes mellitus of lactose-conjugated thiosemicarbazones from substituted acetophenones	8
Design, synthesis, and neuroprotective activity of salidroside-based dual inhibitors of selective monoamine oxidase B and amyloid-β aggregation	8
Tranilast-tyrosine hybrid molecule exhibits dual activity: suppression of epithelial-mesenchymal transition and induction of cytotoxicity in cancer cells	8
Hit-to-lead optimization of amino-carboxamide benzothiazoles as LSD1 inhibitors	8
Drug repositioning of benzimidazole anthelmintics in the treatment of cryptococcosis: a review	7
Structural optimization and biological evaluation of quinoline/naphthalene-based glyoxalase-I inhibitors as anti-cancer candidates	7
Design, synthesis, characterization and cytotoxic activity of new ortho-hydroxy and indole-chalcone derivatives against breast cancer cells (MCF-7)	7
Discovery of novel acridine-chalcone hybrids with potent DNA binding and antiproliferative activity against MDA-MB-231 and MCF-7 cells	7
Stable isotope applications in drug development and the elucidation of mechanisms of drug metabolism	7
In silico drug discovery: a machine learning-driven systematic review	7
Engelheptanoxides behave as liver X receptor α agonists	7
Synthesis, structure-activity relationship and evaluation of antifungal activity of tryptanthrin derivatives against drug-resistant Candida albicans	7
The emerging role of proteolysis targeting chimeras (PROTACs) in the treatment of Alzheimer’s disease	7
Sphingosine 1-phosphate receptor modulators for the treatment of inflammatory bowel disease and other immune-mediated diseases	7
Lipase inhibitory activity of constituents of Physalis glutinosa and Physalis latiphysa	7
Design, synthesis, stereochemical characterization, in vitro α-glucosidase, and α-amylase inhibition and in silico studies of novel pyrazole-hydrazide hydrazones	7
In vitro antiproliferative activity of Parrotia persica exclusive gallotannin	7
Design, synthesis, in vitro evaluation, and molecular dynamics simulation studies of novel coumarin-acetohydrazide Schiff base derivatives as urease enzyme inhibitors	7
Acetylcholinesterase Inhibitors from Carbamate and Benzo-fused Heterocyclic Scaffolds: Promising Therapeutics for Alzheimer’s Disease	7
The potential of chalcone derivatives as human carbonic anhydrase inhibitors in the therapy of glaucoma	7
Synthesis, theoretical investigations and biological evaluation of ibuprofen drug hybrids	7
Synthesis and evaluation of tetrahydrobenzo[cd]indole derivatives as glycogen phosphorylase inhibitors	7
Synthesis of 6-dialkylaminopyrimidine carboxamide analogues and their anti-tubercular properties	7
A glance into Schiff-based α-glucosidase inhibitors in medicinal chemistry	6
Glycosylated triptolide affords a potent in vivo therapeutic activity to hepatocellular carcinoma in mouse model	6
Synthesis, pharmacological and molecular docking investigations of 1,3,4-oxadiazole-5-thionyl derivatives of extracted cis-clerodane diterpenoid from Cistus monspeliensis	6
Esters and amides of benzofuroxan-1-N–oxide derivatives as trypanocidal and leishmanicidal agents	6
SARS-CoV-2 3CL-protease inhibitors derived from ML300: investigation of P1 and replacements of the 1,2,3-benzotriazole	6
CO as a potential therapeutic agent: an initial investigation of dosing and concentration dynamics in solution	6
New tetracyclic systems integrated thienopyridine scaffold as an anti-dementia lead: in silico study and biological screening	6
A reliable and automated synthesis of 6-[18F]fluoro-L-DOPA and the clinical application on the imaging of congenital hyperinsulinism of infants	6
4-Phenylcoumarins from Mesua ferrea with selective CYP1B1 inhibitory activity	6
Research progress on antidiabetic activity of apigenin derivatives	6
ATP-hydrolyzing, DNA-damaging and cytotoxic activities of peptide-targeted cobalt(III) complex with diethylentriamine	6
Optimization of clofibrate with natural product sesamol for reducing liver injury induced by acetaminophen	6
Anticancer and antimicrobial activities of new thiazolyl-urea derivatives: gene expression, DNA damage, DNA fragmentation and SAR studies	6
Anticancer potential of nicotinonitrile derivatives as PIM-1 kinase inhibitors through apoptosis: in vitro and in vivo studies	6
Novel antimicrobial ciprofloxacin-pyridinium quaternary ammonium salts with improved physicochemical properties and DNA gyrase inhibitory activity	6
The use of single-molecule FRET for the characterization of Holliday junctions containing human telomeric DNA: a methodological approach for nanoscale distance, mobility, and stability measurements	6
Sulfonamide derivatives of cis-imidazolines as potent p53-MDM2/MDMX protein-protein interaction inhibitors	6
Ferrocene-based compounds: promising anticancer and antimalarial agents in modern therapeutics	6
Does the negatively charged phosphate backbone contribute to stabilize the complex between cationic organic molecules and G-quadruplex structures? From guessing to calculating	6
Synthesis, and docking studies of arylhydrazone compounds and evaluation of their platelet aggregation inhibitory effect and cytotoxicity	6
Identification of α-mangostin as a potent inhibitor of β-lactamase OXA-48	6
Novel vitamin K3 analogs containing 3-N-substituted aromatic and piperazine rings with selective in vitro anticancer activity against HeLa, U87 MG, and MCF-7 cells	6
2-substituted 4-aminoquinazoline derivatives as potential dual inhibitors of EGFR and HER2: an in silico and in vitro study	6
Translating G-quadruplex ligands from bench to bedside: a Stephen Neidle’s legacy	6
Harnessing the necessary nitrogen atom in chemical biology and drug discovery	6
Exploring the latest breakthroughs in rhodesain inhibitors for African trypanosomiasis	6
Chemical composition and vasodilator activity of different Alpinia zerumbet leaf extracts, a potential source of bioactive flavonoids	6
Synthesis, characterization and biological evaluation of formononetin derivatives as anticancer agents	6
CO prodrugs: a new scaffold of adamantane-fused norbornen-7-ones with tunable water solubility	5
Acyl glucuronides–mediators of drug-induced toxicities?	5
Benzocaine-N-acylindoline conjugates: synthesis and antiviral activity against Coxsackievirus B3	5
Synthesis of new calix[4]arene derivatives and evaluation of their cytotoxic activity	5

Correction to: Structure-activity relationships and pharmacokinetic evaluation of L-cystine diamides as L-cystine crystallization inhibitors for cystinuria	5
N-Phosphorylation of daunorubicin—synthetic approaches and antiproliferative properties of the products	5
Synthesis, biological evaluation, and molecular modeling studies of a new series of imidazothiazole or imidazooxazole derivatives as inhibitors of ectonucleoside triphosphate diphosphohydrolases (NTPD	5
Naturally occurring plant-derived sulfonated and sulfated saponins from 1983 to 2024	5
Withania coagulans: a comprehensive exploration of its botanical, phytochemical, and pharmacological properties	5
Synthesis and anti-leishmanial activities of uniflorol analogues	5
A second life for the crystallographic structure of Berenil-dodecanucleotide complex: a computational revisitation thirty years after its publication	5
Design and synthesis of novel cycloalkanecarboxamide parabanic acid hybrids as anticonvulsants	5
The emergence of sulfo-click amidation in kinetic target-guided synthesis	5
Underpinning the role of natural products against cisplatin-induced nephrotoxicity in rodent models	5
Substituted furan-carboxamide and Schiff base derivatives as potential hypolipidemic compounds: evaluation in Triton WR-1339 hyperlipidemic rat model	5
Prenylated flavonoids icariin and icaritin for drug discovery: structural modifications and bioactivity studies	5
Novel Benzo[4,5]imidazo[1,2-a]pyrimidine derivatives as selective Cyclooxygenase-2 Inhibitors: Design, synthesis, docking studies, and biological evaluation	5
An in vitro and in silico α-amylase/α-glucosidase/protein tyrosine phosphatase 1 beta & radical scavenging profiling of the 3,5,7-tricarbo substituted 1H-indazoles	5
Design and synthesis of O-glycoside derivatives with promising antidiabetic and anticancer potential	5
Preliminary structure−activity relationships analysis on N-(3,5-dichlorophenyl)-4,5-dihydronaphtho[1,2-d]thiazol-2-amine, a disruptor of mycobacterial energetics	5
An update on the discovery and development of reversible covalent inhibitors	5
Design, synthesis, and fungicidal activity of pyrimidinamine derivatives containing pyridin-2-yloxy moiety	5
Exploring nucleoside analogs: key targets in the viral life cycle - advancing strategies against SARS-CoV-2	5
Correction: Substituted furan-carboxamide and Schiff base derivatives as potential hypolipidemic compounds: evaluation in Triton WR-1339 hyperlipidemic rat model	5
Bioassay-guided fractionations of Cannabis sativa extract and HPLC-assisted purifications of anti-proliferative active fractions lead to the isolation of 16 known and one new phytomolecule and their i	5
Platanic acid derived amides are more cytotoxic than their corresponding oximes	5
A novel sight of the primary active compounds from Umbelliferae: focusing on mitochondria	5
New indolo-β-lactam hybrids as potential anticancer and anti-inflammatory agents	5
Development of novel fluoro-substituted rivastigmine derivatives as selective AChE inhibitors for the treatment of AD	5
Synthesis, characterization and in vitro anti-proliferative effects of pentacyclic triterpenoids	5
Synthesis and analgesic potential of 4-[4–chloro-3- (trifluoromethyl)-phenyl]-4-piperidinol analogues against pain model in mice	5
Investigation of the monoamine oxidase inhibition properties of benzoxathiolone derivatives	5
Phytochemical constituents isolated from Silene popovii Schischk	5
Design and synthesis of aminothiazole-benzazole based amide: antiproliferative, antimigration activity and molecular docking studies	5
The anti-inflammatory effects of iridoid glycosides: a comprehensive review of mechanisms of action and structure-activity relationships	5
Translational insights from species differences in the metabolism of triclosan	5
Recent pharmacological insights about imidazole hybrids: a comprehensive review	5
Synthesis and evaluation of new 2-oxo-1,2-dihydroquinoline-3-carboxamides as potent inhibitors against acetylcholinesterase enzyme	5
Promising Schiff bases in antiviral drug design and discovery	5
Morpholinated curcuminoids against urinary bladder cancer cells: synthesis and anticancer evaluation	5
Design, synthesis and anti-tumor activity evaluation of 4,6,7-substitute quinazoline derivatives	5
Hybrid-based design and biological evaluation of quinoline-benzoylhydrazine based derivatives as α-glucosidase inhibitors	5
Pyrrolopyrazine derivatives: synthetic approaches and biological activities	5