Chemical Biology & Drug Design

Papers
(The TQCC of Chemical Biology & Drug Design is 5. The table below lists those papers that are above that threshold based on CrossRef citation counts [max. 250 papers]. The publications cover those that have been published in the past four years, i.e., from 2020-03-01 to 2024-03-01.)
ArticleCitations
Antioxidant activities and mechanisms of polysaccharides98
Extraction, separation, modification, structural characterization, and antioxidant activity of plant polysaccharides90
Alpha‐amylase as molecular target for treatment of diabetes mellitus: A comprehensive review85
The recent challenges of highly contagious COVID‐19, causing respiratory infections: Symptoms, diagnosis, transmission, possible vaccines, animal models, and immunotherapy81
Caspase‐3: A primary target for natural and synthetic compounds for cancer therapy64
1,3,4‐oxadiazole and its derivatives: A review on recent progress in anticancer activities63
Chromones: Privileged scaffold in anticancer drug discovery44
Preparation, structure, and properties of tea polysaccharide34
Computational design and modeling of nanobodies toward SARS‐CoV‐2 receptor binding domain33
SARS‐CoV‐2 and its variants of concern including Omicron: A never ending pandemic32
Repurposing potential of FDA‐approved and investigational drugs for COVID‐19 targeting SARS‐CoV‐2 spike and main protease and validation by machine learning algorithm32
Deciphering the detailed structure–activity relationship of coumarins as Monoamine oxidase enzyme inhibitors—An updated review31
Ginsenoside Rg1 improves Alzheimer's disease by regulating oxidative stress, apoptosis, and neuroinflammation through Wnt/GSK‐3β/β‐catenin signaling pathway28
Therapeutic potential and pharmacological activities of β‐eudesmol28
Application of molecular dynamics simulation in biomedicine26
Evolution of peptide nucleic acid with modifications of its backbone and application in biotechnology25
Antimicrobial and antiproliferative activities of novel synthesized 6‐(quinolin‐2‐ylthio) pyridine derivatives with molecular docking study as multi‐targeted JAK2/STAT3 inhibitors25
Recent advances in Bcr‐Abl tyrosine kinase inhibitors for overriding T315I mutation25
Focal adhesion kinase—An emerging viable target in cancer and development of focal adhesion kinase inhibitors24
Quinoline‐derivatives as privileged scaffolds for medicinal and pharmaceutical chemists: A comprehensive review23
Extraction, derivatization, and antioxidant activity of Morinda citrifolia polysaccharide23
Specific delivering of RNAi using Spike's aptamer‐functionalized lipid nanoparticles for targeting SARS‐CoV‐2: A strong anti‐Covid drug in a clinical case study23
An overview on synthetic and pharmaceutical prospective of pyrido[2,3‐d]pyrimidines scaffold22
A minireview of 1,2,3‐triazole hybrids with O‐heterocycles as leads in medicinal chemistry21
Extraction and deproteinization process of polysaccharide from purple sweet potato21
Novel imidazo[2,1‐b]thiazole‐based anticancer agents as potential focal adhesion kinase inhibitors: Synthesis, in silico and in vitro evaluation21
Antibiotic–cell‐penetrating peptide conjugates targeting challenging drug‐resistant and intracellular pathogenic bacteria21
Machine learning approaches and their applications in drug discovery and design21
Recent progress in materials development and biological properties of GTR membranes for periodontal regeneration19
Discovery of two novel ALKBH5 selective inhibitors that exhibit uncompetitive or competitive type and suppress the growth activity of glioblastoma multiforme19
Pyrimidine: An elite heterocyclic leitmotif in drug discovery‐synthesis and biological activity19
Alantolactone: A sesquiterpene lactone with diverse pharmacological effects19
Isoniazid–phytochemical conjugation: A new approach for potent and less toxic anti‐TB drug development19
Quinoline‐based thiazolidinone derivatives as potent cytotoxic and apoptosis‐inducing agents through EGFR inhibition18
Design and synthesis of isothiocyanate‐containing hybrid androgen receptor (AR) antagonist to downregulate AR and induce ferroptosis in GSH–Deficient prostate cancer cells18
Artificial intelligence and machine learning for protein toxicity prediction using proteomics data17
The flavonoid Astragalin shows anti‐tumor activity and inhibits PI3K/AKT signaling in gastric cancer17
Extraction, structural analysis, and activities of rice bran polysaccharide17
In silico prediction of drug‐induced ototoxicity using machine learning and deep learning methods16
Icaritin activates Nrf2/Keap1 signaling to protect neuronal cells from oxidative stress16
A review on computer‐aided chemogenomics and drug repositioning for rationalCOVID‐19 drug discovery16
Therapeutic potential of ferulic acid and its derivatives in Alzheimer’s disease—A systematic review16
Anticancer and antileishmanial in vitro activity of gold(I) complexes with 1,3,4‐oxadiazole‐2(3H)‐thione ligands derived from δ‐D‐gluconolactone16
Design, synthesis, and biological evaluation of piperidinyl‐substituted [1,2,4]triazolo[1,5‐a]pyrimidine derivatives as potential anti‐HIV‐1 agents with reduced cytotoxicity16
Friedlӓnder's synthesis of quinolines as a pivotal step in the development of bioactive heterocyclic derivatives in the current era of medicinal chemistry16
Pinoresinol diglucoside alleviates ischemia/reperfusion‐induced brain injury by modulating neuroinflammation and oxidative stress15
Anticancer properties and pharmaceutical applications of ginsenoside compound K: A review15
Benzimidazole‐based protein kinase inhibitors: Current perspectives in targeted cancer therapy15
Alantolactone induces apoptosis in THP‐1 cells through STAT3, survivin inhibition, and intrinsic apoptosis pathway15
Potent antibacterial activity of dihydydropyrimidine‐1,3,5‐triazines via inhibition of DNA gyrase and antifungal activity with favourable metabolic profile14
Tetrazole: A privileged scaffold for the discovery of anticancer agents14
Recent progress of research on anti‐tumor agents using benzimidazole as the structure unit14
Design strategies, SAR, and mechanistic insight of Aurora kinase inhibitors in cancer14
Vascular endothelial growth factor‐loaded poly‐lactic‐co‐glycolic acid nanoparticles with controlled release protect the dopaminergic neurons in Parkinson's rats14
Synthesis and in vitro antileishmanial efficacy of novel quinazolinone derivatives14
Ginkgetin alleviates high glucose‐evoked mesangial cell oxidative stress injury, inflammation, and extracellular matrix (ECM) deposition in an AMPK/mTOR‐mediated autophagy axis14
Role of Pd(II)–chitooligosaccharides–Gboxin analog in oxidative phosphorylation inhibition and energy depletion: Targeting mitochondrial dynamics14
The importance of co‐delivery of nanoparticle‐siRNA and anticancer agents in cancer therapy14
Preparation and antioxidant activity of phosphorylated polysaccharide from purple sweet potato14
Multiple function of lncRNA MALAT1 in cancer occurrence and progression13
A comprehensive review on glucokinase activators: Promising agents for the treatment of Type 2 diabetes13
Biological evaluation of Keggin‐type polyoxometalates on tyrosinase: Kinetics and molecular modeling13
Radiosynthesis and in silico bioevaluation of 131I‐Sulfasalazine as a highly selective radiotracer for imaging of ulcerative colitis13
A review of the effects and molecular mechanisms of dimethylcurcumin (ASC‐J9) on androgen receptor‐related diseases13
Spectrum of deep learning algorithms in drug discovery13
Alginate oligosaccharide alleviates senile osteoporosis via the RANKL–RANK pathway in D‐galactose‐induced C57BL/6J mice13
Inhibition of human CYP1 enzymes by a classical inhibitor α‐naphthoflavone and a novel inhibitor N‐(3, 5‐dichlorophenyl)cyclopropanecarboxamide: An in vitro and in silico study13
GWOVina: A grey wolf optimization approach to rigid and flexible receptor docking13
Emerging quinoline‐ and quinolone‐based antibiotics in the light of epidemics13
Molecular mechanisms of anticancer activities of polyphyllin VII12
Epigallocatechin‐3‐O‐gallate ameliorates oxidative stress‐induced chondrocyte dysfunction and exerts chondroprotective effects via the Keap1/Nrf2/ARE signaling pathway12
Multiple interactions between melatonin and non‐coding RNAs in cancer biology12
Programmed cell death ligand‐1: A dynamic immune checkpoint in cancer therapy12
Design, synthesis and biological evaluation of N‐substituted indole‐thiazolidinedione analogues as potential pancreatic lipase inhibitors12
Discovery of novel antibacterial agents: Recent developments in D‐alanyl‐D‐alanine ligase inhibitors12
Extraction, structural characterization, and physicochemical properties of polysaccharide from purple sweet potato12
Synergistic antifungal effects of curcumin derivatives as fungal biofilm inhibitors with fluconazole12
A new insight into the treatment of diabetes by means of pan PPAR agonists12
Elucidating specificity of an allosteric inhibitor WNK476 among With‐No‐Lysine kinase isoforms using molecular dynamic simulations12
Predicting adverse drug reactions of two‐drug combinations using structural and transcriptomic drug representations to train an artificial neural network12
Emerging chemical scaffolds with potential SHP2 phosphatase inhibitory capabilities – A comprehensive review11
Integrated molecular modeling techniques to reveal selective mechanisms of inhibitors to PI3Kδ with marketed Idelalisib11
Development and radiosterilization of new hydrazono‐quinoline hybrids as DNA gyrase and topoisomerase IV inhibitors: Antimicrobial and hemolytic activities against uropathogenic 11
Evaluation of small molecule kinase inhibitors as novel antimicrobial and antibiofilm agents11
Structure‐based derivation and optimization of YAP‐like coactivator‐derived peptides to selectively target TEAD family transcription factors by hydrocarbon stapling and cyclization11
Design, synthesis, and biological evaluation of novel imidazo[1,2‐a]pyridinecarboxamides as potent anti‐tuberculosis agents11
A novel peptide isolated from garlic shows anticancer effect against leukemic cell lines via interaction with Bcl‐2 family proteins11
Extraction, chemical modification, and antioxidant activities of Daucus carota polysaccharide11
Synthesis, extracorporeal nephrotoxicity, and 3D‐QSAR of andrographolide derivatives11
Current status of quinoxaline and quinoxaline 1,4‐di‐N‐oxides derivatives as potential antiparasitic agents11
Designing of kinase hinge binders: A medicinal chemistry perspective11
Methyl brevifolincarboxylate, a novel influenza virus PB2 inhibitor from Canarium Album (Lour.) Raeusch11
Design, synthesis, and evaluation of novel heteroaryldihydropyrimidine derivatives as non‐nucleoside hepatitis B virus inhibitors by exploring the solvent‐exposed region11
Averting transmission: A pivotal target to manage amoebiasis10
Secondary structure dependence of amyloid‐β(1–40) on simulation techniques and force field parameters10
Comprehensive review on natural pharmacophore tethered 1,2,3‐triazoles as active pharmaceuticals10
A comprehensive review of recent advances in the biological activities of quinazolines10
Symbiotic prodrugs (SymProDs) dual targeting of NFkappaB and CDK10
Optimization of fermentation conditions for the production of epothilone B10
An insight into therapeutic efficacy of heterocycles as histone‐modifying enzyme inhibitors that targets cancer epigenetic pathways10
99mTc‐labeled antibiotics for infection diagnosis: Mechanism, action, and progress10
Insights into the structure and drug design of benzimidazole derivatives targeting the epidermal growth factor receptor (EGFR)10
Review on target domains and natural compound‐based inhibitors of fatty acid synthase for anticancer drug discovery9
Some important inhibitors and mechanisms of rheumatoid arthritis9
Synthesis and in vitro anticancer activities of selenium N‐heterocyclic carbene compounds9
DNA intercalators as anticancer agents9
Gambogenic acid suppresses bladder cancer cells growth and metastasis by regulating NF‐κB signaling9
Frontiers in G‐Quadruplex therapeutics in cancer: Selection of small molecules, peptides and aptamers9
Rational design of novel N‐alkyl amine analogues of noscapine, their chemical synthesis and cellular activity as potent anticancer agents9
Development of quinoline‐based hybrid as inhibitor of methionine aminopeptidase 1 from Leishmania donovani9
Discovery of potent α‐glucosidase inhibitors through structure‐based virtual screening of an in‐house azole collection9
SANTAMARINE: Mechanistic studies on multiple diseases9
Synthetic molecules targeting yes associated protein activity as chemotherapeutics against cancer9
Histamine H3 receptor and cholinesterases as synergistic targets for cognitive decline: Strategies to the rational design of multitarget ligands9
Facile synthesis and antimycobacterial activity of isoniazid, pyrazinamide and ciprofloxacin derivatives9
Triterpenes from Poria cocos are revealed as potential retinoid X receptor selective agonists based on cell and in silico evidence9
Characterisation of a novel peptide, Brevinin‐1H, from the skin secretion of Amolops hainanensis and rational design of several analogues8
LncRNA SNHG15: A potential therapeutic target in the treatment of colorectal cancer8
Classification of beta‐site amyloid precursor protein cleaving enzyme 1 inhibitors by using machine learning methods8
Antiaggregant effects of (1,2,5‐oxadiazolyl)azasydnone ring assemblies as novel antiplatelet agents8
Design of new truncated derivatives based on direct and reverse mirror repeats of first six residues of Caerin 4 antimicrobial peptide and evaluation of their activity and cytotoxicity8
Multitask deep networks with grid featurization achieve improved scoring performance for protein–ligand binding8
Overcoming vincristine resistance in cancer: Computational design and discovery of piperine‐inspired P‐glycoprotein inhibitors8
Identification of potential drug–targets by combining evolutionary information extracted from frequency profiles and molecular topological structures8
Gallotannins are non‐specific inhibitors of α‐amylase: Aggregates are the active species taking part in inhibition8
Application of porcupine inhibitors in stem cell fate determination8
Design, synthesis and antifungal evaluation of novel mandelic acid derivatives containing a 1,3,4‐oxadiazothioether moiety8
Natural naphthoquinones and their derivatives as potential drug molecules against trypanosome parasites8
Design and fabrication of dual‐targeted delivery system based on gemcitabine‐conjugated human serum albumin nanoparticles8
Fragment‐based in silico design of SARS‐CoV‐2 main protease inhibitors8
Synthesis and antiviral activity of diverse heterocyclic scaffolds7
Glucosyl‐1,2,3‐triazoles derived from eugenol and analogues: Synthesis, anti‐Candida activity, and molecular modeling studies in CYP‐517
Applications of machine‐learning methods for the discovery of NDM‐1 inhibitors7
Structure‐based discovery of Licoflavone B and Ginkgetin targeting c‐Myc G‐quadruplex to suppress c‐Myc transcription and myeloma growth7
Hydroxysafflor yellow A protects against ulcerative colitis via suppressing TLR4/NF‐κB signaling pathway7
Pyronaridine induces apoptosis in non‐small cell lung cancer cells by upregulating death receptor 5 expression and inhibiting epidermal growth factor receptor7
Tachyplesin induces apoptosis in non‐small cell lung cancer cells and enhances the chemosensitivity of A549/DDP cells to cisplatin by activating Fas and necroptosis pathway7
Chemical composition analysis and antioxidant activity of black rice pigment7
Green synthesis and characterization of Solanum xanthocarpum capped silver nanoparticles and its antimicrobial effect on multidrug‐resistant bacterial (MDR) isolates7
Synthesis and biological activity profile of novel triazole/quinoline hybrids7
Explainability and white box in drug discovery7
Novel quantitative structure–activity relationship model to predict activities of natural products against COVID‐197
Design, microwave‐assisted synthesis, biological evaluation and molecular modeling studies of 4‐phenylthiazoles as potent fatty acid amide hydrolase inhibitors7
Molecular docking‐guided synthesis of NSAID–glucosamine bioconjugates and their evaluation as COX‐1/COX‐2 inhibitors with potentially reduced gastric toxicity7
Pyrrolidin‐2‐one linked benzofused heterocycles as novel small molecule monoacylglycerol lipase inhibitors and antinociceptive agents7
Synthetic heterocyclic derivatives as promising xanthine oxidase inhibitors: An overview7
A natural language processing approach based on embedding deep learning from heterogeneous compounds for quantitative structure–activity relationship modeling7
Structure‐based non‐nucleoside inhibitor design: Developing inhibitors that are effective against resistant mutants7
Molecular dynamics simulations provide molecular insights into the role of HLA‐B51 in Behçet's disease pathogenesis7
Eukaryotic phosphatase inhibitors enhance colistin efficacy in gram‐negative bacteria7
The role of FoxO1 and its modulation with small molecules in the development of diabetes mellitus: A review7
Synthesis, biological evaluation, and molecular modeling studies of acetophenones‐tethered 1,2,4‐triazoles and their oximes as epidermal growth factor receptor inhibitors7
Perspectives on cutting‐edge nanoparticulate drug delivery technologies based on lipids and their applications7
Development of potent inhibitors by fragment‐linking strategies7
Review on marine sponge alkaloid, aaptamine: A potential antibacterial and anticancer drug7
Design, synthesis, and molecular modeling of quinoline‐based derivatives as anti‐breast cancer agents targeting EGFR/AKT signaling pathway6
Recent advances in antifungal drug development targeting lanosterol 14α‐demethylase (CYP51): A comprehensive review with structural and molecular insights6
Synthesis of new coumarin[1,3]oxazine derivatives of 7‐hydroxy‐6‐isobornyl‐4‐methylcoumarin and their antioxidant activity6
1H‐1,2,3‐triazole embedded Isatin‐Benzaldehyde‐bis(heteronuclearhydrazones): design, synthesis, antimycobacterial, and cytotoxic evaluation6
Computational‐based discovery of FAK FERM domain chemical probes that inhibit HER2‐FAK cancer signaling6
Therapeutic efficacy of caffeic acid phenethyl ester in cancer therapy: An updated review6
Rational drug discovery: Ellagic acid as a potent dual‐target inhibitor against hepatitis C virus genotype 3 (HCV G3) NS3 enzymes6
Design, synthesis and biological evaluation of benz‐fused five‐membered heterocyclic compounds as tubulin polymerization inhibitors with anticancer activities6
Downregulation of NRARP exerts anti‐tumor activities in the breast tumor cells depending on Wnt/β‐catenin‐mediated signals: The role of miR‐130a‐3p6
Baicalin mitigated IL‐1β‐Induced osteoarthritis chondrocytes damage through activating mitophagy6
ELIOT: A platform to navigate the E3 pocketome and aid the design of new PROTACs6
Cytotoxic effects of vitamins K1, K2, and K3 against human T lymphoblastoid leukemia cells through apoptosis induction and cell cycle arrest6
Benchmarking analysis of deleterious SNP prediction tools on CYP2D6 enzyme6
Pyrazolopyridine: An efficient pharmacophore in recent drug design and development6
TMLRpred: A machine learning classification model to distinguish reversible EGFR double mutant inhibitors6
Antitumour properties based on the self‐assembly of camptothecin and carbamoylmannose conjugates6
Role of exosomal miRNA in chemotherapy resistance of Colorectal cancer: A systematic review6
4‐Sulfonyloxy/alkoxy benzoxazolone derivatives with high anti‐inflammatory activities: Synthesis, biological evaluation, and mechanims of action via p38/ERK‐NF‐κB/iNOS pathway6
Current understanding and future prospects on Berberine for anticancer therapy6
Synthesis and activities of acetylcholinesterase inhibitors6
Isoquinolines alkaloids and cancer metabolism: Pathways and targets to novel chemotherapy6
OTU deubiquitinase 5 inhibits the progression of non‐small cell lung cancer via regulating p53 and PDCD56
Formulation, optimization and characterization of raloxifene hydrochloride loaded PLGA nanoparticles by using Taguchi design for breast cancer application6
Antihypertensive activity and molecular interactions of irbesartan in complex with 2‐hydroxypropyl‐β‐cyclodextrin6
Antifungal activity of styrylpyridinium compounds against Candida albicans6
[99mTc‐HYNIC/EDDA]‐MccJ25 antimicrobial peptide analog as a potential radiotracer for detection of infection6
Modulation of co‐stimulatory signal from CD2–CD58 proteins by a grafted peptide6
Use of neomycin as a structured amino‐containing side chain motif for phenanthroline‐based G‐quadruplex ligands and telomerase inhibitors6
Pharmacophore screening, denovo designing, retrosynthetic analysis, and combinatorial synthesis of a novel lead VTRA1.1 against RecA protein of Acinetobacter baumannii6
Identification of selective mtbDHFR inhibitors by virtual screening and experimental approaches6
Theoretical study of myriocin‐binding mechanism targeting serine palmitoyltransferase6
Identification of novel P2X7R antagonists by using structure‐based virtual screening and cell‐based assays6
Synthesis of 2‐Chloro‐3‐amino indenone derivatives and their evaluation as inhibitors of DNA dealkylation repair6
An appraisal on synthetic and pharmaceutical perspectives of quinoxaline 1,4‐di‐N‐oxide scaffold6
Gossypin: A flavonoid with diverse pharmacological effects6
Identification of catalytic and non‐catalytic activity inhibitors against PRC2‐EZH2 complex through multiple high‐throughput screening campaigns6
Synthesis and activity of novel indirubin derivatives6
Synthesis, structural investigations, and in vitro biological activity of Co(II) and Fe(III) mixed ligand complexes of 1,10‐phenanthroline and 2,2′‐bipyridine5
Sulfonated non‐saccharide molecules and human factor XIa: Enzyme inhibition and computational studies5
Synergy between machine learning and natural products cheminformatics: Application to the lead discovery of anthraquinone derivatives5
Peptidomimetic‐based approach toward inhibitors of microbial trimethylamine lyases5
Fingerprint‐based computational models of 5‐lipo‐oxygenase activating protein inhibitors: Activity prediction and structure clustering5
99mTc‐(EDDA/tricine)‐HYNIC‐GnRH analogue as a potential imaging probe for diagnosis of prostate cancer5
Synthetic peptides bioinspired in temporin‐PTa with antibacterial and antibiofilm activity5
Delineating binding potential, stability of Sulforaphane‐N‐acetyl‐cysteine in the active site of histone deacetylase 2 and testing its cytotoxicity against distinct cancer lines through stringent mol5
Pyrimidine derivatives as EGFR tyrosine kinase inhibitors in non‐small‐cell lung cancer: A comprehensive review5
Sesamin exerts anti‐tumor activity in esophageal squamous cell carcinoma via inhibition of TRIM44 and NF‐κB signaling5
Selection of antimicrobial frog peptides and temporin‐1DRa analogues for treatment of bacterial infections based on their cytotoxicity and differential activity against pathogens5
Synthesis and inhibitory activities of inhibitors for the treatment of Alzheimer’s disease5
Synthesis and discovery of potential tyrosinase inhibitor of new coumarin‐based thiophenyl‐pyrazolylthiazole nuclei: In vitro evaluation, cytotoxicity, kinetic, and computational studies5
Design and development of novel fasudil derivatives as potent antibreast cancer agent that improves intestinal flora and intestinal barrier function in rats5
The effect of multiple simulation parameters on MM/PBSA performance for binding affinity prediction of CB1 cannabinoid receptor agonists and antagonists5
Design, synthesis, and biological evaluation of benzo[b]thiophene 1,1‐dioxide derivatives as potent STAT3 inhibitors5
In silico and in vitro studies of a number PILs as new antibacterials against MDR clinical isolate Acinetobacter baumannii5
Identification of three new compounds that directly target human serine hydroxymethyltransferase 25
Design, synthesis, and modelling study of new 1,2,3‐triazole/chalcone hybrids with antiproliferative action as epidermal growth factor receptor inhibitors5
1,3,4‐oxadiazole derivatives as potential antimicrobial agents5
Synthesis, in vitro and in silico anti‐bacterial analysis of piperine and piperic ester analogues5
Silicon switch: Carbon–silicon Bioisosteric replacement as a strategy to modulate the selectivity, physicochemical, and drug‐like properties in anticancer pharmacophores5
3‐O‐trans‐caffeoyloleanolic acid improves acute lung injury via anti‐inflammation and antioxidative stress‐involved PI3K/AKT pathway5
Design, synthesis and anti‐inflammatory study of novel N‐heterocyclic substituted Aloe‐emodin derivatives5
MiR‐27a‐3p targets USP46 to inhibit the cell proliferation of hepatocellular carcinoma5
Ternary complex formation of AFN‐1252 with Acinetobacter baumannii FabI and NADH: Crystallographic and biochemical studies5
Intrinsic drug potential of oxazolo[5,4‐d]pyrimidines and oxazolo[4,5‐d]pyrimidines5
Interleukin‐25 recognition by its unique receptor IL‐17Rb via two discrete linear and cyclic epitopes5
A systematic literature review for the prediction of anticancer drug response using various machine‐learning and deep‐learning techniques5
W2476 represses TXNIP transcription via dephosphorylation of FOXO1 at Ser3195
Association of sigma‐1 receptor with dopamine transporter attenuates the binding of methamphetamine via distinct helix–helix interactions5
Dithiocarbamate derivatives inhibit α‐glucosidase through an apparent allosteric site on the enzyme5
Synthesis, and antimalarial and antibacterial activities of marine alkaloids5
Design and synthesis of a novel peptide for selective detection of cancer cells5
The rise of deep learning and transformations in bioactivity prediction power of molecular modeling tools5
Cyanidin as potential anticancer agent targeting various proliferative pathways5
ACPS: An accurate bioinformatics tool for precision‐based anti‐cancer peptide generation via omics data5
SARS‐CoV‐2 first contact: Spike–ACE2 interactions in COVID‐195
‘Targeting the feast of a sleeping beast’: Nutrient and mineral dependencies of encysted Acanthamoeba castellanii5
Synthesis, biological evaluation, molecular modeling, and structural analysis of new pyrazole and pyrazolone derivatives as N‐formyl peptide receptors agonists5
Isoginkgetin inhibits inflammatory response in the fibroblast‐like synoviocytes of rheumatoid arthritis by suppressing matrix metallopeptidase 9 expression5
Chemotherapeutic potentials of β‐ionone against Trypanosoma congolense infection: Inhibition of parasite proliferation, anemia development, trans‐sialidase (TconTS3 and TconTS4) g5
The salivary exosomal microRNA as a potential biomarker in patients with periodontitis and oral cancers5
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