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Conformational Restriction: An Effective Tactic in ‘Follow-On’-Based Drug Discovery

https://doi.org/10.4155/fmc.14.50

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inferred← citeshttps://doi.org/10.1002/slct.202404252openalex-snapshot

Design, Synthesis, and Insecticidal Activity of 3‐(6‐Methyltriazinone)‐3,4‐dihydrobenzo[ b ][1,5]diazin‐2(1 H )‐ones: Conformationally Restricted Pymetrozine Analogues

inferred← citeshttps://doi.org/10.1002/tcr.202300276openalex-snapshot

Insights into Modeling Approaches in Chemistry: Assessing Ligand‐Protein Binding Thermodynamics Based on Rigid‐Flexible Model Molecules

inferred← citeshttps://doi.org/10.1007/978-1-4939-9752-7_12openalex-snapshot

Docking with SwissDock

inferred← citeshttps://doi.org/10.1007/s00018-019-03194-2openalex-snapshot

Rational design of agonists for bitter taste receptor TAS2R14: from modeling to bench and back

inferred← citeshttps://doi.org/10.1007/s00044-023-03073-3openalex-snapshot

Harnessing the necessary nitrogen atom in chemical biology and drug discovery

inferred← citeshttps://doi.org/10.1007/s00253-015-7261-2openalex-snapshot

Biocatalytic reduction of racemic 2-arenoxycycloalkanones by yeasts P. glucozyma and C. glabrata: one way of achieving chiral 2-arenoxycycloalcohols

inferred← citeshttps://doi.org/10.1007/s00726-018-2660-1openalex-snapshot

A conformationally restricted GABA analogue based on octahydro-1H-cyclopenta[b]pyridine scaffold

inferred← citeshttps://doi.org/10.1007/s10822-026-00931-1openalex-snapshot

Machine learning for discovering anticancer compounds from plants and elucidating their mechanisms

inferred← citeshttps://doi.org/10.1007/s10989-024-10682-yopenalex-snapshot

Advances in Homing Peptide Targeted Therapies

inferred← citeshttps://doi.org/10.1007/s11094-022-02708-wopenalex-snapshot

In Vitro Cytotoxicity of Methano[1,2,4]Triazolo-[1,5-C][1,3,5]Benzoxadiazocine Derivatives and Their Effects on Nitrite and Prostaglandin E2 (PGE2) Levels

inferred← citeshttps://doi.org/10.1007/s11426-024-2485-3openalex-snapshot

Nickel-catalyzed ligand-controlled switchable skeletal rearrangements: divergent synthesis of isoquinoline-1,3-diones, cyclohexenols, cycloheptenols, and 2-benzazepin-5-ones

inferred← citeshttps://doi.org/10.1016/b978-0-443-21861-3.00016-4openalex-snapshot

Discovery and development of MRTX1133, a potent, selective, noncovalent inhibitor of KRASG12D

inferred← citeshttps://doi.org/10.1016/j.apsb.2022.09.022openalex-snapshot

Harnessing the cyclization strategy for new drug discovery

inferred← citeshttps://doi.org/10.1016/j.bbagen.2017.08.015openalex-snapshot

Evaluation of proline analogs as trypanocidal agents through the inhibition of a Trypanosoma cruzi proline transporter

inferred← citeshttps://doi.org/10.1016/j.bbamem.2017.09.021openalex-snapshot

Flexibility vs rigidity of amphipathic peptide conjugates when interacting with lipid bilayers

inferred← citeshttps://doi.org/10.1016/j.bioorg.2018.10.071openalex-snapshot

Design, synthesis, biological evaluation and dynamics simulation of indazole derivatives with antiangiogenic and antiproliferative anticancer activity

inferred← citeshttps://doi.org/10.1016/j.bioorg.2020.103595openalex-snapshot

Pharmacophore-fusing design of pyrimidine sulfonylacetanilides as potent non-nucleoside inhibitors of HIV-1 reverse transcriptase

inferred← citeshttps://doi.org/10.1016/j.bioorg.2021.105349openalex-snapshot

4-Flourophenyl-substituted 5H-indeno[1,2-b]pyridinols with enhanced topoisomerase IIα inhibitory activity: Synthesis, biological evaluation, and structure–activity relationships

inferred← citeshttps://doi.org/10.1016/j.bioorg.2023.106890openalex-snapshot

Repurposing of conformationally-restricted cyclopentane-based AKT–inhibitors leads to discovery of potential and more selective antileishmanial agents than miltefosine

inferred← citeshttps://doi.org/10.1016/j.bioorg.2024.107236openalex-snapshot

Bibenzyl and naphthalene derivatives from Dendrobium chrysanthum and their anti-hepatic-steatosis activities

inferred← citeshttps://doi.org/10.1016/j.bioorg.2024.107875openalex-snapshot

Synthesis and in vitro exploration of the 8-carbo substituted 5-methoxyflavones as anti-breast and anti-lung cancer agents targeting protein kinases (VEGFR-2 & EGFR)

inferred← citeshttps://doi.org/10.1016/j.bioorg.2025.108190openalex-snapshot

A perspective on the application of macrocyclic design strategies in antitumor drugs

inferred← citeshttps://doi.org/10.1016/j.bioorg.2025.108465openalex-snapshot

Synthesis and profiling (in vitro and in silico) of the 6-methoxy/hydroxy substituted 7-acetyl-2-aryl-5-bromobenzofurans for antihyperglycemic, cytotoxic and antioxidant properties

inferred← citeshttps://doi.org/10.1016/j.bioorg.2025.108952openalex-snapshot

Design, synthesis, biological and computational evaluation of novel S/N-glycerolyl and peptide-conjugated [1,2,4]triazolo[1,5-a]pyrimidine derivatives as potent CDK2 inhibitors for anticancer therapy

inferred← citeshttps://doi.org/10.1016/j.bioorg.2026.110631openalex-snapshot

Photoredox and PIFA-mediated synthesis of N-aryl azacoumestanes: Antileukemic activity and venetoclax synergism in acute myeloid leukemia

inferred← citeshttps://doi.org/10.1016/j.bmc.2016.04.008openalex-snapshot

Discovery and optimization of 1,7-disubstituted-2,2-dimethyl-2,3-dihydroquinazolin-4(1H)-ones as potent and selective PKCθ inhibitors

inferred← citeshttps://doi.org/10.1016/j.bmc.2019.02.034openalex-snapshot

Effective syntheses of 2′,4′-BNANC monomers bearing adenine, guanine, thymine, and 5-methylcytosine, and the properties of oligonucleotides fully modified with 2′,4′-BNANC

inferred← citeshttps://doi.org/10.1016/j.bmc.2024.118042openalex-snapshot

Discovery of 2-(6-{[(1R,2R)-2-hydroxycyclohexyl]amino}-4,5-dimethylpyridazin-3-yl)-5-(trifluoromethyl)phenol (ASP0965): A potent, orally active and brain-penetrable NLRP3 inflammasome inhibitor with a novel scaffold for the treatment of α-synucleinopathy

inferred← citeshttps://doi.org/10.1016/j.bmcl.2015.03.082openalex-snapshot

Classifying shape coverage in fragment libraries using a fingerprinting approach

inferred← citeshttps://doi.org/10.1016/j.bmcl.2017.03.090openalex-snapshot

Generation of tricyclic imidazo[1,2-a]pyrazines as novel PI3K inhibitors by application of a conformational restriction strategy

inferred← citeshttps://doi.org/10.1016/j.bmcl.2017.04.079openalex-snapshot

Conformational control in structure-based drug design

inferred← citeshttps://doi.org/10.1016/j.bmcl.2018.02.056openalex-snapshot

Structure-based design and structure-activity relationships of 1,2,3,4-tetrahydroisoquinoline derivatives as potential PDE4 inhibitors

inferred← citeshttps://doi.org/10.1016/j.bmcl.2019.03.029openalex-snapshot

Structure-guided design of antibacterials that allosterically inhibit DNA gyrase

inferred← citeshttps://doi.org/10.1016/j.bmcl.2020.127299openalex-snapshot

Design, synthesis, and biological evaluation of spiroindolines as novel inducers of oligodendrocyte progenitor cell differentiation—Use of a conformation-based hypothesis to facilitate compound design

inferred← citeshttps://doi.org/10.1016/j.bmcl.2020.127475openalex-snapshot

Discovery of novel histone lysine methyltransferase G9a/GLP (EHMT2/1) inhibitors: Design, synthesis, and structure-activity relationships of 2,4-diamino-6-methylpyrimidines

inferred← citeshttps://doi.org/10.1016/j.bmcl.2021.128003openalex-snapshot

Holistic drug design for multiparameter optimization in modern small molecule drug discovery

inferred← citeshttps://doi.org/10.1016/j.bmcl.2022.128884openalex-snapshot

Discovery of a novel 2-spiroproline steroid mimetic scaffold for the potent inhibition of 11β-HSD1

inferred← citeshttps://doi.org/10.1016/j.bmcl.2024.129887openalex-snapshot

Novel selective proline-based peptidomimetics for human cathepsin K inhibition

inferred← citeshttps://doi.org/10.1016/j.bmcl.2024.130087openalex-snapshot

Discovery of novel tetracyclic quinazolines as multi-KRAS inhibitors for the treatment of solid tumors

inferred← citeshttps://doi.org/10.1016/j.bmcl.2025.130439openalex-snapshot

Synthesis and antitumor activities of quaternary carbon-containing selenolactones

inferred← citeshttps://doi.org/10.1016/j.bmcl.2026.130614openalex-snapshot

Aryl-functionalized mono- and diketone curcumin derivatives inhibit SARS-CoV-2 Spike:ACE2 interactions

inferred← citeshttps://doi.org/10.1016/j.cclet.2023.108349openalex-snapshot

Medicinal chemistry strategies in the discovery and optimization of HBV core protein allosteric modulators (2018–2022 update)

inferred← citeshttps://doi.org/10.1016/j.cclet.2024.110758openalex-snapshot

Synthesis of rigidified cyclohexanes enabled by visible-light-induced trifluoroacetylsilane-mediated [2 + 2] cycloaddition of cyclopropenes

inferred← citeshttps://doi.org/10.1016/j.chroma.2026.467137openalex-snapshot

Diastereomer separation of phosphorothioate oligonucleotides via conformationally stabilizing ion pairs in reversed-phase liquid chromatography

inferred← citeshttps://doi.org/10.1016/j.crchbi.2022.100028openalex-snapshot

Stereochemical diversity as a source of discovery in chemical biology

inferred← citeshttps://doi.org/10.1016/j.csbj.2019.01.012openalex-snapshot

Stapled Peptides Inhibitors: A New Window for Target Drug Discovery

inferred← citeshttps://doi.org/10.1016/j.drudis.2026.104673openalex-snapshot

Medicinal chemistry strategies to breach the blood–brain barrier: structural design principles for brain-targeted therapeutics

inferred← citeshttps://doi.org/10.1016/j.drup.2024.101053openalex-snapshot

Target-based drug design strategies to overcome resistance to antiviral agents: opportunities and challenges

inferred← citeshttps://doi.org/10.1016/j.ejmech.2016.03.074openalex-snapshot

Design, synthesis and biological evaluation of pyrazol-furan carboxamide analogues as novel Akt kinase inhibitors

inferred← citeshttps://doi.org/10.1016/j.ejmech.2017.10.063openalex-snapshot

Synthesis of unprecedented steroidal spiro heterocycles as potential antiproliferative drugs

inferred← citeshttps://doi.org/10.1016/j.ejmech.2017.11.051openalex-snapshot

Synthesis and bio-inspired optimization of drimenal: Discovery of chiral drimane fused oxazinones as promising antifungal and antibacterial candidates

inferred← citeshttps://doi.org/10.1016/j.ejmech.2019.07.017openalex-snapshot

Discovery of pyrazole-thiophene derivatives as highly Potent, orally active Akt inhibitors

inferred← citeshttps://doi.org/10.1016/j.ejmech.2019.111603openalex-snapshot

Conformational restriction design of thiophene-biphenyl-DAPY HIV-1 non-nucleoside reverse transcriptase inhibitors

inferred← citeshttps://doi.org/10.1016/j.ejmech.2020.112143openalex-snapshot

Structurally novel PI3Kδ/γ dual inhibitors characterized by a seven-membered spirocyclic spacer: The SARs investigation and PK evaluation

inferred← citeshttps://doi.org/10.1016/j.ejmech.2020.112491openalex-snapshot

Structure-based design, synthesis and bioactivity evaluation of macrocyclic inhibitors of mutant isocitrate dehydrogenase 2 (IDH2) displaying activity in acute myeloid leukemia cells

inferred← citeshttps://doi.org/10.1016/j.ejmech.2020.112714openalex-snapshot

Discovery and optimization of benzenesulfonamides-based hepatitis B virus capsid modulators via contemporary medicinal chemistry strategies

inferred← citeshttps://doi.org/10.1016/j.ejmech.2020.113038openalex-snapshot

Development of Mcl-1 inhibitors for cancer therapy

inferred← citeshttps://doi.org/10.1016/j.ejmech.2020.113060openalex-snapshot

Development of 2,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one inhibitors of aldehyde dehydrogenase 1A (ALDH1A) as potential adjuncts to ovarian cancer chemotherapy

inferred← citeshttps://doi.org/10.1016/j.ejmech.2022.114808openalex-snapshot

Design, synthesis, and evaluation of 4(1H)-quinolinone and urea derivatives as KRASG12C inhibitors with potent antitumor activity against KRAS-mutant non-small cell lung cancer

inferred← citeshttps://doi.org/10.1016/j.ejmech.2023.115242openalex-snapshot

Design, synthesis, and biological evaluation of novel dihydropteridone derivatives possessing oxadiazoles moiety as potent inhibitors of PLK1

inferred← citeshttps://doi.org/10.1016/j.ejmech.2023.115286openalex-snapshot

Discovery of a spirocyclic 3-bromo-4,5-dihydroisoxazole covalent inhibitor of hGAPDH with antiproliferative activity against pancreatic cancer cells

inferred← citeshttps://doi.org/10.1016/j.ejmech.2023.115532openalex-snapshot

Identification of 5-[5-cyano-1-(pyridin-2-ylmethyl)-1H-indole-3-carboxamido] thiazole-4-carboxylic acid as a promising dual inhibitor of urate transporter 1 and xanthine oxidase

inferred← citeshttps://doi.org/10.1016/j.ejmech.2023.116109openalex-snapshot

Advancements in dual-target inhibitors of PI3K for tumor therapy: Clinical progress, development strategies, prospects

inferred← citeshttps://doi.org/10.1016/j.ejmech.2024.116357openalex-snapshot

Discovery and optimization of narrow spectrum inhibitors of Tousled like kinase 2 (TLK2) using quantitative structure activity relationships

inferred← citeshttps://doi.org/10.1016/j.ejmech.2024.116947openalex-snapshot

Advances in synthesis of novel annulated azecines and their unique pharmacological properties

inferred← citeshttps://doi.org/10.1016/j.ejmech.2025.117368openalex-snapshot

Spirocyclic compounds as innovative tools in drug discovery for medicinal chemists

inferred← citeshttps://doi.org/10.1016/j.ejmech.2025.118076openalex-snapshot

Development of pyrazolo[1,5-a]pyrimidine based macrocyclic kinase inhibitors targeting AAK1

inferred← citeshttps://doi.org/10.1016/j.ejmech.2026.118796openalex-snapshot

Design and synthesis of novel ATP-citrate lyase inhibitors and their effects on MAFLD/MASH

inferred← citeshttps://doi.org/10.1016/j.ijmst.2026.09.005openalex-snapshot

Molecular conformation and rigidity as determinants of selectivity in dual-functional depressants for bastnaesite-fluorite-calcite flotation systems: Experimental and DFT investigation

inferred← citeshttps://doi.org/10.1016/j.jbc.2024.107991openalex-snapshot

Flexible fluorine-thiol displacement stapled peptides with enhanced membrane penetration for the estrogen receptor/coactivator interaction

inferred← citeshttps://doi.org/10.1016/j.jfluchem.2023.110163openalex-snapshot

Synthesis, structure, in vitro and in silico enzyme (COX-1/2 and VEGFR-2) inhibition studies of the 2-arylsulfonamidoacetophenones

inferred← citeshttps://doi.org/10.1016/j.jfluchem.2023.110233openalex-snapshot

Structure and biological property studies of the fluorinated sulfonic esters derived from 2-hydroxy-4-(hydroxy/methoxy)acetophenone as inhibitors of biochemical targets linked to type 2 diabetes mellitus

inferred← citeshttps://doi.org/10.1016/j.jfluchem.2026.110594openalex-snapshot

Investigating the effect of stereospecific fluorination on the potency and selectivity of the tricyclic antidepressant, imipramine

inferred← citeshttps://doi.org/10.1016/j.jhazmat.2024.133977openalex-snapshot

The hapten rigidity improves antibody performances in immunoassay for rifamycins: Immunovalidation and molecular mechanism

inferred← citeshttps://doi.org/10.1016/j.jmgm.2018.11.015openalex-snapshot

Computational conformational analysis of α-thrombin inhibitors possessing distinct scaffolds in aqueous solution and on Ala-sheet

inferred← citeshttps://doi.org/10.1016/j.molstruc.2019.127267openalex-snapshot

Melatonin pharmacophoric motifs in the anancomeric spiranic oxindole-cycloalkane scaffold: Theoretical and 1H NMR conformational analysis

inferred← citeshttps://doi.org/10.1016/j.molstruc.2023.136501openalex-snapshot

Spectroscopic and computational studies of the noncovalent interactions in the structures of the 2-hydroxy-3-iodo-6-methoxybenzenecarbonyl (-C(O)CH3, -CHO) derivatives

inferred← citeshttps://doi.org/10.1016/j.molstruc.2023.136901openalex-snapshot

Synthesis, crystal structure,anti-tuberculosis activity and toxicity prediction of N-(4-bromophenyl)-3-(5-(4-chloro-3-nitrophenyl)-1,3,4-oxadiazol-2-yl)benzenesulfonamide

inferred← citeshttps://doi.org/10.1016/j.molstruc.2024.137785openalex-snapshot

Design, synthesis and evaluation of the 2′-hydroxy-3′-iodo-5′-nitrochalcones for cytotoxicity (MCF-7 & A549) and potential to inhibit tyrosine kinase (VEGFR-2) activity

inferred← citeshttps://doi.org/10.1016/j.molstruc.2025.142304openalex-snapshot

Eco-innovative pesticide discovery via conformation restriction strategy: balancing efficacy and environmental safety

inferred← citeshttps://doi.org/10.1016/j.molstruc.2025.144408openalex-snapshot

Evaluation of Δ²-1,3,4-thiadiazolines derived from thiosemicarbazones for antichagasic activity: Insights into structural limitations

inferred← citeshttps://doi.org/10.1016/j.saa.2023.123816openalex-snapshot

An Optimized Purification Protocol for Enzymatically Synthesized S-Adenosyl-L-Methionine (Sam) for Applications in Solution State Infrared Spectroscopic Studies

inferred← citeshttps://doi.org/10.1016/j.snb.2026.139659openalex-snapshot

Rapid screening of paratope-targeting peptides for the detection of anti-PD-1 monoclonal antibodies

inferred← citeshttps://doi.org/10.1016/j.tet.2015.11.067openalex-snapshot

Approaches to polyunsaturated sphingolipids: new conformationally restrained analogs with minimal structural modifications

inferred← citeshttps://doi.org/10.1016/j.tet.2023.133296openalex-snapshot

Expedient synthesis of spiro[3.3]heptan-1-ones via strain-relocating semipinacol rearrangements

inferred← citeshttps://doi.org/10.1016/j.tetasy.2016.08.011openalex-snapshot

An update on the stereoselective synthesis of γ-amino acids

inferred← citeshttps://doi.org/10.1016/j.tetlet.2018.11.047openalex-snapshot

Synthesis of azabicyclo[n.1.0]alkane-derived bifunctional building blocks via the Corey–Chaykovsky cyclopropanation

inferred← citeshttps://doi.org/10.1016/j.tetlet.2024.155391openalex-snapshot

A practical synthesis of Cbz protected (1R,2R) and (1S,2S) 2-hydroxy-cyclobutylamines

inferred← citeshttps://doi.org/10.1021/acs.accounts.3c00334openalex-snapshot

Lewis Acid-Promoted [2 + 2] Cycloadditions of Allenes and Ketenes: Versatile Methods for Natural Product Synthesis

inferred← citeshttps://doi.org/10.1021/acs.jcim.5c02720openalex-snapshot

Prediction of Atropisomerism for Drug-like Molecules

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.0c00371openalex-snapshot

Synthesis and Antichlamydial Activity of Molecules Based on Dysregulators of Cylindrical Proteases

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.0c00829openalex-snapshot

Opportunities for Tapping into Three-Dimensional Chemical Space through a Quaternary Carbon

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.1c00217openalex-snapshot

Synthetic Opportunities and Challenges for Macrocyclic Kinase Inhibitors

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.1c00926openalex-snapshot

Discovery and Preclinical Characterization of BIIB091, a Reversible, Selective BTK Inhibitor for the Treatment of Multiple Sclerosis

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.1c01059openalex-snapshot

Discovery of EEDi-5273 as an Exceptionally Potent and Orally Efficacious EED Inhibitor Capable of Achieving Complete and Persistent Tumor Regression

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.1c01688openalex-snapshot

Identification of MRTX1133, a Noncovalent, Potent, and Selective KRAS G12D Inhibitor

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.1c01758openalex-snapshot

Contemporary Medicinal Chemistry Strategies for the Discovery and Development of Novel HIV-1 Non-nucleoside Reverse Transcriptase Inhibitors

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.1c02063openalex-snapshot

Intramolecular Interactions Enhance the Potency of Gallinamide A Analogues against Trypanosoma cruzi

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.2c00969openalex-snapshot

Recent Scaffold Hopping Applications in Central Nervous System Drug Discovery

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.3c00134openalex-snapshot

Macrocycles in Drug Discovery─Learning from the Past for the Future

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.3c00446openalex-snapshot

The Role of Allylic Strain for Conformational Control in Medicinal Chemistry

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.3c01980openalex-snapshot

Synthesis of Pyrazole-Based Macrocycles Leads to a Highly Selective Inhibitor for MST3

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.4c00220openalex-snapshot

Discovery and Preclinical Characterization of BIIB129, a Covalent, Selective, and Brain-Penetrant BTK Inhibitor for the Treatment of Multiple Sclerosis

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.4c00227openalex-snapshot

Discovery and Optimization of Potent, Efficacious and Selective Inhibitors Targeting EGFR Exon20 Insertion Mutations

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.4c02202openalex-snapshot

Redesigning Berberines and Sanguinarines to Target Soluble Epoxide Hydrolase for Enhanced Anti-Inflammatory Efficacy

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.4c03120openalex-snapshot

Design, Synthesis, and Biological Activity of Novel Ornithine Decarboxylase (ODC) Inhibitors

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.5b00229openalex-snapshot

Strategies for the Discovery of Target-Specific or Isoform-Selective Modulators

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.5b00497openalex-snapshot

Anti-HIV Drug Discovery and Development: Current Innovations and Future Trends

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.5c00394openalex-snapshot

Identification of a RANKL/TNF-α Dual-Inhibitor as a Potential Disease-Modifying Agent for the Treatment of Knee Osteoarthritis

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.5c01100openalex-snapshot

Scaffold Hopping in Tuberculosis Drug Discovery: Principles, Applications, and Case Studies

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.5c01780openalex-snapshot

Discovery of 1-Difluoromethyl-3-(3-cyanophenyl)-6-[4-(trifluoromethoxy)phenyl]imidazo[1,5- a ]pyrazin-8-(7 H )-one as a Potent P2Y1 Antagonist for the Treatment of Ischemic Stroke and Myocardial Infarction

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.5c01799openalex-snapshot

Design of 2-Aminobenzothiazole Derivatives Targeting Trypanosomatid PTR1 by a Multidisciplinary Fragment Hybridization Approach

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.6c00333openalex-snapshot

Mitigating Excessive Mitochondrial Fission Through the Development of a Selective Macrocyclic Inhibitor Targeting Fis1/Mid51 Signaling

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.6c01714openalex-snapshot

Molecular Construction and Anti-Bladder Cancer Study of Novel TOP1/PARP1 Dual-Target Inhibitors

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.8b00360openalex-snapshot

Discovery of Aminopiperidine Indoles That Activate the Guanine Nucleotide Exchange Factor SOS1 and Modulate RAS Signaling

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.8b01238openalex-snapshot

Effect of α-Methoxy Substitution on the Anti-HIV Activity of Dihydropyrimidin-4(3H)-ones

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.9b00796openalex-snapshot

Synthesis and Pharmacological Characterization of Conformationally Restricted Retigabine Analogues as Novel Neuronal Kv7 Channel Activators

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.9b00891openalex-snapshot

Discovery of 3,4,6-Trisubstituted Piperidine Derivatives as Orally Active, Low hERG Blocking Akt Inhibitors via Conformational Restriction and Structure-Based Design

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.9b00972openalex-snapshot

A Conformational Restriction Strategy for the Identification of a Highly Selective Pyrimido-pyrrolo-oxazine mTOR Inhibitor

inferred← citeshttps://doi.org/10.1021/acs.jnatprod.4c00037openalex-snapshot

Facile Synthesis and First Antifungal Exploration of Tetracyclic Meroterpenoids: (+)-Aureol, (−)-Pelorol, and Its Analogs

inferred← citeshttps://doi.org/10.1021/acs.joc.1c00705openalex-snapshot

Stereoselective Synthesis of (S)- and (N)-Cyclopropyl-Fused Carbocyclic Nucleosides Using Stereoselective Cyclopropanation

inferred← citeshttps://doi.org/10.1021/acs.joc.2c01661openalex-snapshot

Conformationally Locked Carbocyclic Nucleosides Built on a 4′-Hydroxymethyl-3′-hydroxybicyclo[4.1.0]heptane Template. Stereoselective Synthesis and Antiviral Activity

inferred← citeshttps://doi.org/10.1021/acs.joc.2c02892openalex-snapshot

Expanding the Chemical Space of 1,2-Difunctionalized Cyclobutanes

inferred← citeshttps://doi.org/10.1021/acs.joc.4c02390openalex-snapshot

4-Azaspiro[2.3]hexane, an Overlooked Piperidine Isostere: Multigram Synthesis and Physicochemical and Structural Evaluation

inferred← citeshttps://doi.org/10.1021/acs.joc.6c00618openalex-snapshot

Condition-Controlled Divergent Access to Spirodihydrofurans, Biscoumarins, Tetraketones, and Bisindenetetraones from Alkyne-Tethered Indenediones

inferred← citeshttps://doi.org/10.1021/acs.joc.9b03044openalex-snapshot

Building the Housane: Diastereoselective Synthesis and Characterization of Bicyclo[2.1.0]pentane Carboxylic Acids

inferred← citeshttps://doi.org/10.1021/acs.jpca.5c08122openalex-snapshot

Conformational Stability through B···O Triel Bonding: A Computational Investigation of Dioxaborolane–Oxoacetates Derivatives

inferred← citeshttps://doi.org/10.1021/acs.orglett.0c03020openalex-snapshot

Polycyclizations of Ketoesters: Synthesis of Complex Tricycles with up to Five Stereogenic Centers from Available Starting Materials

inferred← citeshttps://doi.org/10.1021/acs.orglett.4c03082openalex-snapshot

Access to Bicyclo[3.1.0]hexane and Cyclopenta[ c ]pyrazole Scaffolds via Solvent-Directed Divergent Reactivity of 5-Iodotriazoles

inferred← citeshttps://doi.org/10.1021/acs.orglett.4c03692openalex-snapshot

Divergent Access to Polycyclic Fluorenofuran Systems via Palladium-Catalyzed Cascade Furan-Participated Diels–Alder Cycloaddition Reactions

inferred← citeshttps://doi.org/10.1021/acs.orglett.5c00590openalex-snapshot

Phosphoric Acid-Catalyzed Enantioselective Synthesis of Axially Chiral Cyclobutanamides

inferred← citeshttps://doi.org/10.1021/acs.orglett.5c02499openalex-snapshot

Subtle Strain-Release-Driven Aroylation of Four-Membered Rings via Decarboxylative Giese-Type Reactions

inferred← citeshttps://doi.org/10.1021/acs.orglett.5c05218openalex-snapshot

Asymmetric Transfer Hydrogenation of Hemisquaramides: Access to Enantioenriched α-Hydroxy-3-aminocyclobutenone Derivatives

inferred← citeshttps://doi.org/10.1021/acs.orglett.6c00665openalex-snapshot

Dual Strain-Release Cascade for Accessing sp 3 -Rich Azetidine–Bicyclopentane Frameworks Bearing Multiple Quaternary Carbon Centers

inferred← citeshttps://doi.org/10.1021/acs.orglett.6c00767openalex-snapshot

Synthesis of gem -Difluoro Spirocyclic Cyclopropyl Mannosyl-1-phosphate Analogues and Chemoenzymatic Preparation of ADP- and GDP-Spirocyclopropyl-mannose

inferred← citeshttps://doi.org/10.1021/acs.orglett.6c01133openalex-snapshot

Modular Synthesis of Triaroyl Cyclopropanes via a Formal Cyclotrimerization of Phenacyl Bromides and Their Transformation into Diazabicycles

inferred← citeshttps://doi.org/10.1021/acs.orglett.6c01478openalex-snapshot

Nucleophiles as Reaction Switches: Dearomative Multifunctionalization of Isoquinoliniums to Rigid Bridged-Ring Architectures

inferred← citeshttps://doi.org/10.1021/acscatal.3c05616openalex-snapshot

Regio- and Diastereoselective Highly Strained Alkylidenecyclobutane Isomerization/Hydroacylation: Synthesis of Multisubstituted Cyclobutanes with Consecutive Stereocenters

inferred← citeshttps://doi.org/10.1021/acscatal.5c06260openalex-snapshot

Synthesis of Enantioenriched Borylated Cyclopropanols from Photoexcited Acylsilanes

inferred← citeshttps://doi.org/10.1021/acscatal.5c06645openalex-snapshot

Syntheses, Mechanism Insights, and Anti-Inflammatory Activities of Conformationally Defined [ n ]Metacyclophanes

inferred← citeshttps://doi.org/10.1021/acscatal.6b00943openalex-snapshot

Synthesis of Conformationally Constrained Esters and Amines by Pd-Catalyzed α-Arylation of Hindered Substrates

inferred← citeshttps://doi.org/10.1021/acsmedchemlett.0c00200openalex-snapshot

ONO-8430506: A Novel Autotaxin Inhibitor That Enhances the Antitumor Effect of Paclitaxel in a Breast Cancer Model

inferred← citeshttps://doi.org/10.1021/acsmedchemlett.1c00391openalex-snapshot

The Discovery of Conformationally Constrained Bicyclic Peptidomimetics as Potent Hepatitis C NS5A Inhibitors

inferred← citeshttps://doi.org/10.1021/acsmedchemlett.1c00648openalex-snapshot

Antibacterial Activity of Metergoline Analogues: Revisiting the Ergot Alkaloid Scaffold for Antibiotic Discovery

inferred← citeshttps://doi.org/10.1021/acsmedchemlett.3c00127openalex-snapshot

Design and Synthesis of Pyrazole-Based Macrocyclic Kinase Inhibitors Targeting BMPR2

inferred← citeshttps://doi.org/10.1021/acsmedchemlett.3c00154openalex-snapshot

Conformationally Restricted Analogues of α-Galactosylceramide as Adjuvant in COVID-19 Subunit Vaccine

inferred← citeshttps://doi.org/10.1021/acsmedchemlett.4c00037openalex-snapshot

Discovery of Hepatitis B Virus Surface Antigen Suppressor GS-8873

inferred← citeshttps://doi.org/10.1021/acsmedchemlett.5c00155openalex-snapshot

Design and Synthesis of Pyrazoline Inhibitors of SARS-CoV-2 NSP14

inferred← citeshttps://doi.org/10.1021/acsmedchemlett.7b00383openalex-snapshot

Discovery of a Slow Tight Binding LPA1 Antagonist (ONO-0300302) for the Treatment of Benign Prostatic Hyperplasia

inferred← citeshttps://doi.org/10.1021/acsomega.3c07668openalex-snapshot

Synthesis and Biological Evaluation of Lysophosphatidic Acid Analogues Using Conformational Restriction and Bioisosteric Replacement Strategies

inferred← citeshttps://doi.org/10.1021/acsomega.4c09421openalex-snapshot

Structural Basis for the Improved RNA Clamping of Amidino-Rocaglates to eIF4A1

inferred← citeshttps://doi.org/10.1021/acsptsci.4c00125openalex-snapshot

Structure–Activity Relationship Study of Tris-Benzamides as Estrogen Receptor Coregulator Binding Modulators

inferred← citeshttps://doi.org/10.1021/bk-2020-1369.ch006openalex-snapshot

Discovery and Chemical Development of S 44563, a Dual Bcl-2/Bcl-xL Inhibitor

inferred← citeshttps://doi.org/10.1021/jacs.3c05699openalex-snapshot

Palladium-Catalyzed Trans-Selective Synthesis of Spirocyclic Cyclobutanes Using α,α-Dialkylcrotyl- and Allylhydrazones

inferred← citeshttps://doi.org/10.1021/jacs.4c11296openalex-snapshot

Formal [2σ + 2σ]-Cycloaddition of Aziridines with Bicyclo[1.1.0]butanes: Access to Enantiopure 2-Azabicyclo[3.1.1]heptane Derivatives

inferred← citeshttps://doi.org/10.1021/jacs.5c20071openalex-snapshot

Ring Constraint Strategy Enabled Cycloaddition of Oxazolones and Alkenes via Photoinduced Energy Transfer

inferred← citeshttps://doi.org/10.1021/jacs.9b03372openalex-snapshot

Streamlined Synthesis of C(sp3)-Rich N-Heterospirocycles Enabled by Visible-Light-Mediated Photocatalysis

inferred← citeshttps://doi.org/10.1038/s41429-022-00500-2openalex-snapshot

Pharmacological evaluation of disulfiram analogs as antimicrobial agents and their application as inhibitors of fosB-mediated fosfomycin resistance

inferred← citeshttps://doi.org/10.1038/s41467-022-33827-3openalex-snapshot

[2]-Ladderanes as isosteres for meta-substituted aromatic rings and rigidified cyclohexanes

inferred← citeshttps://doi.org/10.1038/s41467-024-53571-0openalex-snapshot

Ligand-controlled regiodivergent aminocarbonylation of cyclobutanols toward 1,1- and 1,2-substituted cyclobutanecarboxamides

inferred← citeshttps://doi.org/10.1038/s41467-025-60688-3openalex-snapshot

Structural basis of topoisomerase targeting by delafloxacin

inferred← citeshttps://doi.org/10.1038/s41557-023-01352-5openalex-snapshot

Enyne difluorination

inferred← citeshttps://doi.org/10.1038/s41586-023-06000-zopenalex-snapshot

Transannular C–H functionalization of cycloalkane carboxylic acids

inferred← citeshttps://doi.org/10.1038/s41598-025-18086-8openalex-snapshot

Design and synthesis of novel small molecules targeting the Kv1.3 voltage-gated potassium ion channel

inferred← citeshttps://doi.org/10.1039/c9cs00720bopenalex-snapshot

Advances in covalent kinase inhibitors

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