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Recent updates on third generation EGFR inhibitors and emergence of fourth generation EGFR inhibitors to combat C797S resistance

European journal of medicinal chemistry, 2017-12, Vol.142, p.32-47

2017

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Repurposing Non‐Nucleosidic Reverse Transcriptase Inhibitors (NNRTIs) to Overcome EGFR T790M‐Mediated Acquired Resistance in Non‐Small Cell Lung Cancer

Journal of cellular biochemistry, 2024-09, p.e30653

2024

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Synthesis and in vitro antitumor activity of substituted quinazoline and quinoxaline derivatives: Search for anticancer agent

European journal of medicinal chemistry, 2011-06, Vol.46 (6), p.2327-2346

2011

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In silico search of triple mutant T790M/C797S allosteric inhibitors to conquer acquired resistance problem in non-small cell lung cancer (NSCLC): a combined approach of structure-based virtual screening and molecular dynamics simulation

Journal of biomolecular structure & dynamics, 2021-03, Vol.39 (4), p.1491-1505

2021

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Mycobacterium Tuberculosis (MTB) GyrB inhibitors: An attractive approach for developing novel drugs against TB

European journal of medicinal chemistry, 2016-11, Vol.124, p.160-185

2016

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Benzothiazoles: Search for anticancer agents

European journal of medicinal chemistry, 2012-08, Vol.54, p.447-462

2012

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Pentacyclic Triterpenoids Inhibit IKKβ Mediated Activation of NF-κB Pathway: In Silico and In Vitro Evidences

PloS one, 2015-05, Vol.10 (5), p.e0125709-e0125709

2015

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Molecular dynamics simulation and pharmacokinetics studies of ombuin and quercetin against human pancreatic α-amylase

Journal of biomolecular structure & dynamics, 2023-12, Vol.ahead-of-print (ahead-of-print), p.1-8

2023

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Small hybrid heteroaromatics: resourceful biological tools in cancer research

RSC advances, 2017-01, Vol.7 (45), p.28313-28349

2017

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Exploring MDR‐TB Inhibitory Potential of 4‐Aminoquinazolines as Mycobacterium tuberculosis N‐Acetylglucosamine‐1‐Phosphate Uridyltransferase (GlmUMTB) Inhibitors

Chemistry & biodiversity, 2020-08, Vol.17 (8), p.e2000237-n/a

2020

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N,N,N-Trimethyl chitosan: An advanced polymer with myriad of opportunities in nanomedicine

Carbohydrate polymers, 2017-02, Vol.157, p.875-902

2017

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Design and synthesis of quinazolinones as EGFR inhibitors to overcome EGFR resistance obstacle

Bioorganic & medicinal chemistry, 2017-05, Vol.25 (10), p.2713-2723

2017

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Design, synthesis and molecular docking and ADME studies of novel hydrazone derivatives for AChE inhibitory, BBB permeability and antioxidant effects

Journal of biomolecular structure & dynamics, 2023-12, Vol.41 (18), p.9022-9038

2023

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BREED based de novo hybridization approach: generating novel T790M/C797S-EGFR tyrosine kinase inhibitors to overcome the problem of mutation and resistance in non small cell lung cancer (NSCLC)

Journal of biomolecular structure & dynamics, 2021-05, Vol.39 (8), p.2838-2856

2021

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Anti-malarial and Multi-bioactive Co (II), Cu (II) and Ni (II) Salen Complexes: Synthesis, Characterization and Computational Studies

Chemistry & biodiversity, 2024-06, Vol.21 (9), p.e202400715

2024

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Tomatidine and Patchouli Alcohol as Inhibitors of SARS-CoV-2 Enzymes (3CLpro, PLpro and NSP15) by Molecular Docking and Molecular Dynamics Simulations

International journal of molecular sciences, 2021-10, Vol.22 (19), p.10693

2021

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Two dimensional-QSAR and molecular dynamics studies of a selected class of aldoxime- and hydroxy-functionalized chalcones as monoamine oxidase-B inhibitors

Journal of biomolecular structure & dynamics, 2023-11, Vol.41 (19), p.9256-9266

2023

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Mining of a novel esterase (est3S) gene from a cow rumen metagenomic library with organosphosphorus insecticides degrading capability: Catalytic insights by site directed mutations, docking, and molecular dynamic simulations

International journal of biological macromolecules, 2021-11, Vol.190, p.441-455

2021

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Therapeutic Outcomes of Isatin and Its Derivatives against Multiple Diseases: Recent Developments in Drug Discovery

Pharmaceuticals (Basel, Switzerland), 2022-02, Vol.15 (3), p.272

2022

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Investigating the Impact of Different Acrylamide (Electrophilic Warhead) on Osimertinib's Pharmacological Spectrum by Molecular Mechanic and Quantum Mechanic Approach

Combinatorial chemistry & high throughput screening, 2022-01, Vol.25 (1), p.149-166

2022

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Unveiling chlorpyrifos mineralizing and tomato plant-growth activities of Enterobacter sp. strain HSTU-ASh6 using biochemical tests, field experiments, genomics, and in silico analyses

Frontiers in microbiology, 2022-11, Vol.13, p.1060554-1060554

2022

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Exploring the structural activity relationship of the Osimertinib: A covalent inhibitor of double mutant EGFRL858R/T790M tyrosine kinase for the treatment of Non-Small Cell Lung Cancer (NSCLC)

Bioorganic & medicinal chemistry, 2024-07, Vol.109, p.117796, Article 117796

2024

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Nonlinear molecular dynamics of quercetin in Gynocardia odorata and Diospyros malabarica fruits: Its mechanistic role in hepatoprotection

PloS one, 2022-03, Vol.17 (3), p.e0263917

2022

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Synthesis and anticancer evaluation of novel 2-cyclopropylimidazo[2,1- b][1,3,4]-thiadiazole derivatives

European journal of medicinal chemistry, 2011-09, Vol.46 (9), p.4411-4418

2011

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Introduction of benzyloxy pharmacophore into aryl/heteroaryl chalcone motifs as a new class of monoamine oxidase B inhibitors

Scientific reports, 2022-12, Vol.12 (1), p.22404-19, Article 22404

2022

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Recent updates on third generation EGFR inhibitors and emergence of fourth generation EGFR inhibitors to combat C797S resistance

Repurposing Non‐Nucleosidic Reverse Transcriptase Inhibitors (NNRTIs) to Overcome EGFR T790M‐Mediated Acquired Resistance in Non‐Small Cell Lung Cancer

Synthesis and in vitro antitumor activity of substituted quinazoline and quinoxaline derivatives: Search for anticancer agent

In silico search of triple mutant T790M/C797S allosteric inhibitors to conquer acquired resistance problem in non-small cell lung cancer (NSCLC): a combined approach of structure-based virtual screening and molecular dynamics simulation

Mycobacterium Tuberculosis (MTB) GyrB inhibitors: An attractive approach for developing novel drugs against TB

Benzothiazoles: Search for anticancer agents

Pentacyclic Triterpenoids Inhibit IKKβ Mediated Activation of NF-κB Pathway: In Silico and In Vitro Evidences

Molecular dynamics simulation and pharmacokinetics studies of ombuin and quercetin against human pancreatic α-amylase

Small hybrid heteroaromatics: resourceful biological tools in cancer research

Exploring MDR‐TB Inhibitory Potential of 4‐Aminoquinazolines as Mycobacterium tuberculosis N‐Acetylglucosamine‐1‐Phosphate Uridyltransferase (GlmUMTB) Inhibitors

N,N,N-Trimethyl chitosan: An advanced polymer with myriad of opportunities in nanomedicine

Design and synthesis of quinazolinones as EGFR inhibitors to overcome EGFR resistance obstacle

Design, synthesis and molecular docking and ADME studies of novel hydrazone derivatives for AChE inhibitory, BBB permeability and antioxidant effects

BREED based de novo hybridization approach: generating novel T790M/C797S-EGFR tyrosine kinase inhibitors to overcome the problem of mutation and resistance in non small cell lung cancer (NSCLC)

Anti-malarial and Multi-bioactive Co (II), Cu (II) and Ni (II) Salen Complexes: Synthesis, Characterization and Computational Studies

Tomatidine and Patchouli Alcohol as Inhibitors of SARS-CoV-2 Enzymes (3CLpro, PLpro and NSP15) by Molecular Docking and Molecular Dynamics Simulations

Two dimensional-QSAR and molecular dynamics studies of a selected class of aldoxime- and hydroxy-functionalized chalcones as monoamine oxidase-B inhibitors

Mining of a novel esterase (est3S) gene from a cow rumen metagenomic library with organosphosphorus insecticides degrading capability: Catalytic insights by site directed mutations, docking, and molecular dynamic simulations

Therapeutic Outcomes of Isatin and Its Derivatives against Multiple Diseases: Recent Developments in Drug Discovery

Investigating the Impact of Different Acrylamide (Electrophilic Warhead) on Osimertinib's Pharmacological Spectrum by Molecular Mechanic and Quantum Mechanic Approach

Unveiling chlorpyrifos mineralizing and tomato plant-growth activities of Enterobacter sp. strain HSTU-ASh6 using biochemical tests, field experiments, genomics, and in silico analyses

Exploring the structural activity relationship of the Osimertinib: A covalent inhibitor of double mutant EGFRL858R/T790M tyrosine kinase for the treatment of Non-Small Cell Lung Cancer (NSCLC)

Nonlinear molecular dynamics of quercetin in Gynocardia odorata and Diospyros malabarica fruits: Its mechanistic role in hepatoprotection

Synthesis and anticancer evaluation of novel 2-cyclopropylimidazo[2,1- b][1,3,4]-thiadiazole derivatives

Introduction of benzyloxy pharmacophore into aryl/heteroaryl chalcone motifs as a new class of monoamine oxidase B inhibitors

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