Medicinal Chemistry Research

Article	Citations
Synthesis of the dibenzylbutane lignan LCA derivatives and evaluation of their anti-inflammatory activities	86
Synthesis and antitumor activity evaluation in vitro of 4-aminoquinazoline derivatives containing 1,3,4-thiadiazole	83
Acetylcholinesterase inhibition, molecular docking and ADME prediction studies of new dihydrofuran-piperazine hybrid compounds	78
Synthesis and biological evaluation of novel 1,3-diphenylurea quinoxaline derivatives as potent anticancer agents	56
Monoamine oxidase inhibition by thiazole derivatives substituted with the benzenesulfonamide moiety	53
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	43
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	43
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	41
Asciminib: first FDA approved allosteric inhibitor of BCR-ABL1 for the treatment of chronic myeloid leukemia	37
Novel imino-thiazoloquinoxaline derivatives against renal cell carcinoma: less radiation-damaging approach	33
Synthesis of berberine derivatives and their antiviral activity toward respiratory syncytial virus	31
Plastoquinone analogs: a potential antimicrobial lead structure intensely suppressing Staphylococcus epidermidis and Candida albicans growth	31
Structural simplification and ester bond flipping lead to bis-benzodioxole derivatives as potential hypolipidemic and hepatoprotective agent	30
Design, synthesis and anti-breast cancer properties of butyric ester tethered dihydroartemisinin-isatin hybrids	28
Synthesis and biological evaluation of (20S,24R)-epoxy-dammarane-3β,12β,25-triol derivatives as α-glucosidase and PTP1B inhibitors	28
Antibacterial, antifungal activities and toxicity of new synthetic fatty acid salicylate esters	27
Synthesis of hydrazine containing piperazine or benzimidazole derivatives and their potential as α-amylase inhibitors by molecular docking, inhibition kinetics and in vitro cytotoxicity activity studi	27
Glutathione and glutathione disulfide – their biomedical and pharmaceutical applications	27
Targeting cAMP signaling and phosphodiesterase 4 for liver disease treatment	26
Design, synthesis, and antitumor activity evaluation of carbazole derivatives with potent HDAC inhibitory activity	26
Ellagic acid (EA), a tannin was isolated from Eucalyptus citriodora leaves and its anti-inflammatory activity	26
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	25
Screening of small molecule compounds targeting hnRNPA2 protein	23
Synthesis of nitrogen-containing oleanolic acid derivatives as carbonic anhydrase and acetylcholinesterase inhibitors	22
Synthesis of tetrahydro-β-carboline analogs with N11 modifications and study of their antimalarial activities	22

Recent advances in triazole-benzenesulfonamide hybrids and their biological activities	22
Pyrrolo[2,1-f][1,2,4]triazine: a promising fused heterocycle to target kinases in cancer therapy	22
Synthesis and potential antimicrobial activity of novel α-aminophosphonates derivatives bearing substituted quinoline or quinolone and thiazole moieties	20
Contrasting effect of different crowding agents on pseudoknot RNA stability	19
Synthesis, inhibition effects, molecular docking and theoretical studies as Paraoxonase 1 (PON1) inhibitors of novel 1,4-dihydropyridine substituted sulfonamide derivatives	19
Bioassay-guided isolation and identification of anti-Alzheimer’s active compounds from Spiranthes sinensis (Pers.) Ames	19
Design and synthesis of diphenyl-1H-imidazole analogs targeting Mpro/3CLpro enzyme of SARS-CoV-2	19
Synthesis, crystal structure, and anticancer activity of organotin(IV) complexes based on chlorine substituted aryl ligands	19
Pyrrolobenzodiazepines: natural sources, therapeutic uses, and future in neurological treatments	18
A versatile strategy for the synthesis of various lumazine peptides	18
Medicinal uses, phytochemistry, pharmacology, and taxonomy of Poygonum aviculare L.: a comprehensive review	18
Utilizing mechanistic organic chemistry training to study drug metabolism in preclinical drug discovery/development	17
Enantioselectivity of pinene against Leishmania amazonensis	17
Design, Synthesis, and biological evaluation of pyrazolo-benzothiazole derivatives as a potential therapeutic agent for the treatment of Alzheimer’s disease	17
Evaluation of benzoylacetonitriles as novel anti-neuroinflammatory agents	17
Semi-synthesis and cytotoxicity evaluation of pyrimidine, thiazole, and indole analogues of argentatins A–C from guayule (Parthenium argentatum) resin	17
Development of new donepezil analogs: synthesis, biological screening and in silico study rational	16
Inhibition of protein kinases by proton pump inhibitors: computational screening and in vitro evaluation	16
Exploring thiazole-linked thioureas using alkaline phosphatase assay, biochemical evaluation, computational analysis and structure–activity relationship (SAR) studies	16
Synthesis and biological evaluation of esculetin derivatives as potential anti-HBV agents	16
Novel indanone-chalcone esters with potential anti-Alzheimer effects designed using hybridization and bioisosteric replacement approaches	15
Pks 13 inhibitors—a promising target for future antitubercular agents	15
Polyketides from Neohelicosporium griseum: structure assignment and bioactivity investigation	15
Design, synthesis and evaluation of salicylic acid-donepezil hybrids as functional agents for the treatment of Alzheimer’s disease	15
Role of natural secondary metabolites as HIF-1 inhibitors in cancer therapy	14
α-Glucosidase inhibitory activities of aromatic compounds from the rhizomes of Alpinia galanga	14
Structure–activity relationship investigation of triazole-based kappa opioid receptor agonists	14
Clathrolides A–B: previously undescribed macrocylic lactones from marine demosponge Clathria (Thalysias) vulpina (Lamarck, 1814) as potential antihypertensive leads attenuating angiotensin converting	14
Synthetic studies toward a simplified eleuthoside core	13
A Click Synthesis, Molecular Docking and Biological Evaluation of 1,2,3-triazoles-benzoxazepine hybrid as potential anticancer agents	13
Design and synthesis of potential fungicidal compounds derived from natural products, (-)-menthol and (-)-borneol	13
1,2,3-triazenes and 1,2,3-triazoles as antileishmanial, antitrypanosomal, and antiplasmodial agents	13
Synthesis, bacteria activity and molecular simulation of D-galactose-conjugated thiosemicarbazones of 3-aryl-4-formylsydnones	13
The metabolic fate of izencitinib, a gut-selective pan-JAK inhibitor, in humans. Identification of unusual fecal metabolites and implications for MIST evaluation	13
Design, synthesis and evaluation of aurone and indanone derivatives as novel antitumor agents	13
A vitamin D C/D ring-derived compound with cytotoxicity	13
Novel conjugated 5-alkenyl rhodanine tethered 1,4-benzodioxane derivatives as dual-chitinases inhibitors to hinder the growth of Asian corn borer	13
Synthesis, antiviral evaluation, molecular docking study and cytotoxicity of 5′-phosphorylated 1,2,3-triazolyl nucleoside analogues with thymine and 6-methyl uracil moieties	13
Antitumor studies on celastrol and its derivatives as RORα agonists and RORγ inhibitors based on Alphafold reverse docking strategy	13
Design, synthesis, and evaluation of functionalized 5-(4-arylpiperazin-1-yl)-N-arylpentanamides as selective dopamine D3 receptor ligands	12
Antivirulence therapy: type IV pilus as a druggable target for bacterial infections	12
Synthesis, characterization, and anticancer activity of syringaldehyde-derived chalcones against female cancers	12
Novel 2-aminopyrimidine Schiff bases as possible GABA-AT inhibitors: molecular docking, MAOS, and pharmacological screening	12
Design, synthesis, biological evaluation, and molecular docking of 1,7-dibenzyl-substituted theophylline derivatives as novel BRD4-BD1-selective inhibitors	12
In silico design of antimicrobial oligopeptides based on 3D-QSAR modeling and bioassay evaluation	12
Biological evaluation of imidazopyridine derivatives as potential anticancer agents against breast cancer cells	12
Molecular hybridization method for obtaining paeonol-based fibrate derivatives with potent lipid-lowering and hepatoprotective activity	12
Glycyrrhizin and its derivatives: an emerging secondary metabolite arsenal of Glycyrrhiza glabra	11
Synthesis and biological assessment of triazolo-quinazoline carbothioamide derivatives for p38 MAP kinase inhibition: in-silico and in-vitro approaches	11
A potent therapeutic scaffold fusing quinazolinone/melatonin for future colorectal cancer interventions: design, one-pot synthesis, biological and ADME-tox modeling studies	11

Polyalthia longifolia: phytochemistry, ethnomedicinal importance, nutritive value, and pharmacological activities review	10
Insights on synthetic strategies and structure-activity relationship of donepezil and its derivatives	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
An insight into prodrug strategy for the treatment of Alzheimer’s disease	10
Isatin-linked 4,4-dimethyl-5-methylene-4,5-dihydrothiazole-2-thiols for inhibition of acetylcholinesterase	10
Design, synthesis and antitumor activity evaluation of 2,4,6-trisubstituted quinazoline derivatives containing piperidine moiety	10
Rehmannia glutinosa polysaccharides: a review on structure-activity relationship and biological activity	10
Synthesis and pharmacological evaluation of new disulfides linked to 1,2,4-triazole bearing urea moiety	10
Discovery of potent maternal embryonic leucine zipper kinase (MELK) inhibitors of novel chemotypes using structure-based pharmacophores	10
Antiproliferative effect, cell cycle arrest and apoptosis generation of novel 6-substituted N5-formyltetrahydropyrido[3,2-d]pyrimidine derivatives	10
Synthesis and effects of ginkgolides and ginkgolide B derivatives on platelet activating factor induced platelet aggregation in rabbits	10
Discovery of α-methylene-γ-lactone-δ-epoxy derivatives with anti-cancer activity: synthesis, SAR study, and biological activity	9
CYP3A4 drug metabolism considerations in pediatric pharmacotherapy	9
Structure related α-glucosidase inhibitory activity and molecular docking analyses of phenolic compounds from Paeonia suffruticosa	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
4,5-diazafenylfluorene-rhodanine conjugates promote anoikis in A375 cells via inhibiting PPAR-γ expression	9
Synthesis of functionalized 5-(4-arylpiperazin-1-yl)-N-arylpentanamides and their evaluation as D3 receptor ligands	9
Kaempferia diterpenoids and flavonoids: an overview on phytochemistry, biosynthesis, synthesis, pharmacology, and pharmacokinetics	9
Assessment of the α-glucosidase and α-amylase inhibitory potential of Paliurus spina-christi Mill. and its terpenic compounds	9
Design, synthesis, and neuroprotective activity of salidroside-based dual inhibitors of selective monoamine oxidase B and amyloid-β aggregation	9
Synthesis, in vitro activity, and molecular docking of caffeic acid and resveratrol derivatives against Alzheimer’s disease-related enzymes	9
Synthesis, antiproliferative, and antimicrobial properties of novel phthalimide derivatives	9
Discovery of novel HCV inhibitors: design, synthesis and biological activity of phthalamide derivatives	9
Design, synthesis and molecular docking studies of novel benzimidazole-1,3,4-oxadiazole hybrids for their carbonic anhydrase inhibitory and antioxidant effects	9
Discovery of novel pterostilbene/biphenyl tethered 5-FU based conjugates targeting colorectal cancer: synthesis, cytotoxic and ADMET modeling studies	9
Synthesis and in vitro biological activity of chalcone derivatives as potential antiparasitic agents	9
Pharmacological assessment of disulfide–triazine hybrids: synthesis, enzyme inhibition, and molecular docking study	9
Lipase inhibitory activity of constituents of Physalis glutinosa and Physalis latiphysa	8
Synthesis, theoretical investigations and biological evaluation of ibuprofen drug hybrids	8
The potential of 4-aryl-6-morpholino-3(2H)-pyridazinone-2-arylpiperazinylacetamide as a new scaffold for SIRT2 inhibition: in silico approach guided by pharmacophore mapping and molecular docking	8
Hit-to-lead optimization of amino-carboxamide benzothiazoles as LSD1 inhibitors	8
Anti-TB evaluation of novel 2,3-dihydroquinazolin-4(1H)-ones and in silico studies of the active compounds	8
Design, synthesis, stereochemical characterization, in vitro α-glucosidase, and α-amylase inhibition and in silico studies of novel pyrazole-hydrazide hydrazones	8
Tranilast-tyrosine hybrid molecule exhibits dual activity: suppression of epithelial-mesenchymal transition and induction of cytotoxicity in cancer cells	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
Sphingosine 1-phosphate receptor modulators for the treatment of inflammatory bowel disease and other immune-mediated diseases	8
Isatin derivatives as a new class of aldose reductase inhibitors with antioxidant activity	8
The potential of chalcone derivatives as human carbonic anhydrase inhibitors in the therapy of glaucoma	7
In silico drug discovery: a machine learning-driven systematic review	7
Synthesis, and docking studies of arylhydrazone compounds and evaluation of their platelet aggregation inhibitory effect and cytotoxicity	7
Synthesis of 6-dialkylaminopyrimidine carboxamide analogues and their anti-tubercular properties	7
Discovery of novel acridine-chalcone hybrids with potent DNA binding and antiproliferative activity against MDA-MB-231 and MCF-7 cells	7
Synthesis and evaluation of tetrahydrobenzo[cd]indole derivatives as glycogen phosphorylase inhibitors	7
In vitro antiproliferative activity of Parrotia persica exclusive gallotannin	7
Engelheptanoxides behave as liver X receptor α agonists	7
Stable isotope applications in drug development and the elucidation of mechanisms of drug metabolism	7
Design, synthesis, characterization and cytotoxic activity of new ortho-hydroxy and indole-chalcone derivatives against breast cancer cells (MCF-7)	7
The emerging role of proteolysis targeting chimeras (PROTACs) in the treatment of Alzheimer’s disease	7
Synthesis, structure-activity relationship and evaluation of antifungal activity of tryptanthrin derivatives against drug-resistant Candida albicans	7
Design, synthesis, in vitro evaluation, and molecular dynamics simulation studies of novel coumarin-acetohydrazide Schiff base derivatives as urease enzyme inhibitors	7
A glance into Schiff-based α-glucosidase inhibitors in medicinal chemistry	6
4-Phenylcoumarins from Mesua ferrea with selective CYP1B1 inhibitory activity	6
Carboxamide appended quinoline moieties as potential anti-proliferative agents, apoptotic inducers and Pim-1 kinase inhibitors	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
Sulfonamide derivatives of cis-imidazolines as potent p53-MDM2/MDMX protein-protein interaction inhibitors	6
Structural optimization and biological evaluation of quinoline/naphthalene-based glyoxalase-I inhibitors as anti-cancer candidates	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
Anticancer and antimicrobial activities of new thiazolyl-urea derivatives: gene expression, DNA damage, DNA fragmentation and SAR studies	6
Chemical composition and vasodilator activity of different Alpinia zerumbet leaf extracts, a potential source of bioactive flavonoids	6
ATP-hydrolyzing, DNA-damaging and cytotoxic activities of peptide-targeted cobalt(III) complex with diethylentriamine	6
Acetylcholinesterase Inhibitors from Carbamate and Benzo-fused Heterocyclic Scaffolds: Promising Therapeutics for Alzheimer’s Disease	6
Drug repositioning of benzimidazole anthelmintics in the treatment of cryptococcosis: a review	6
Ferrocene-based compounds: promising anticancer and antimalarial agents in modern therapeutics	6
Structure-based discovery of new polo-like kinase 1 (PLK1) inhibitors as potential anticancer agents via docking-based comparative intermolecular contacts analysis (dbCICA)	6
Design, synthesis, and anticancer activities of 8,9-substituted Luotonin A analogs as novel topoisomerase I inhibitors	6
Harnessing the necessary nitrogen atom in chemical biology and drug discovery	5
CO as a potential therapeutic agent: an initial investigation of dosing and concentration dynamics in solution	5
Identification of α-mangostin as a potent inhibitor of β-lactamase OXA-48	5
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	5
New tetracyclic systems integrated thienopyridine scaffold as an anti-dementia lead: in silico study and biological screening	5
Esters and amides of benzofuroxan-1-N–oxide derivatives as trypanocidal and leishmanicidal agents	5
Exploring nucleoside analogs: key targets in the viral life cycle - advancing strategies against SARS-CoV-2	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
New indolo-β-lactam hybrids as potential anticancer and anti-inflammatory agents	5
A novel sight of the primary active compounds from Umbelliferae: focusing on mitochondria	5
Synthesis and analgesic potential of 4-[4–chloro-3- (trifluoromethyl)-phenyl]-4-piperidinol analogues against pain model in mice	5
Anticancer potential of nicotinonitrile derivatives as PIM-1 kinase inhibitors through apoptosis: in vitro and in vivo studies	5
Translating G-quadruplex ligands from bench to bedside: a Stephen Neidle’s legacy	5
Glycosylated triptolide affords a potent in vivo therapeutic activity to hepatocellular carcinoma in mouse model	5
2-substituted 4-aminoquinazoline derivatives as potential dual inhibitors of EGFR and HER2: an in silico and in vitro study	5

Synthesis, pharmacological and molecular docking investigations of 1,3,4-oxadiazole-5-thionyl derivatives of extracted cis-clerodane diterpenoid from Cistus monspeliensis	5
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	5
Promising Schiff bases in antiviral drug design and discovery	5
Development of novel fluoro-substituted rivastigmine derivatives as selective AChE inhibitors for the treatment of AD	5
Benzocaine-N-acylindoline conjugates: synthesis and antiviral activity against Coxsackievirus B3	5
Optimization of clofibrate with natural product sesamol for reducing liver injury induced by acetaminophen	5
Design, synthesis, and biological evaluation of some 1,2,3-triazole derivatives as novel amide-based inhibitors of soluble epoxide hydrolase	5
Novel antimicrobial ciprofloxacin-pyridinium quaternary ammonium salts with improved physicochemical properties and DNA gyrase inhibitory activity	5
Correction to: Diversifying the xanthine scaffold for potential phosphodiesterase 9A inhibitors: synthesis and validation	5
Research progress on antidiabetic activity of apigenin derivatives	5
Exploring the latest breakthroughs in rhodesain inhibitors for African trypanosomiasis	5
Design, synthesis and anti-tumor activity evaluation of 4,6,7-substitute quinazoline derivatives	5
Substituted furan-carboxamide and Schiff base derivatives as potential hypolipidemic compounds: evaluation in Triton WR-1339 hyperlipidemic rat model	5
CO prodrugs: a new scaffold of adamantane-fused norbornen-7-ones with tunable water solubility	5
Hybrid-based design and biological evaluation of quinoline-benzoylhydrazine based derivatives as α-glucosidase inhibitors	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
SARS-CoV-2 3CL-protease inhibitors derived from ML300: investigation of P1 and replacements of the 1,2,3-benzotriazole	5