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Morpholine hydrazone scaffold： Synthesis, anticancer activity and docking studies

Chinese chemical letters, 2017-03, Vol.28 (3), p.607-611

2017

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In silico identification of promiscuous scaffolds as potential inhibitors of 1-deoxy-d-xylulose 5-phosphate reductoisomerase for treatment of Falciparum malaria

Pharmaceutical biology, 2017-12, Vol.55 (1), p.19-32

2017

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Synthesis, biological evaluation and molecular docking study of benzimidazole derivatives as α-glucosidase inhibitors and anti-diabetes candidates

Journal of molecular structure, 2023-03, Vol.1276, p.134774, Article 134774

2023

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Cytotoxicity of Anchusa arvensis Against HepG-2 Cell Lines: Mechanistic and Computational Approaches

Current topics in medicinal chemistry, 2019-01, Vol.19 (30), p.2805-2813

2019

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Identification of novel inhibitors for SARS-CoV-2 as therapeutic options using machine learning-based virtual screening, molecular docking and MD simulation

Frontiers in molecular biosciences, 2023-03, Vol.10, p.1060076-1060076

2023

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Synthesis, molecular docking and α-glucosidase inhibition of 5-aryl-2-(6′-nitrobenzofuran-2′-yl)-1,3,4-oxadiazoles

Bioorganic chemistry, 2016-06, Vol.66, p.117-123

2016

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Nitazoxanide and azithromycin for the early treatment of COVID‐19: A multi‐spectroscopic, biochemical and computational drug–drug interaction study

Journal of the Chinese Chemical Society (Taipei), 2023-07, Vol.70 (7), p.1568-1579

2023

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Synthesis, in vitro alpha-glucosidase inhibitory potential of benzimidazole bearing bis-Schiff bases and their molecular docking study

Bioorganic chemistry, 2020-01, Vol.94, p.103394, Article 103394

2020

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Synthesis and evaluation of aryl aminomethylene substituted barbiturates and thiobarbiturates as novel α-amylase inhibitors and radical scavengers

Monatshefte für Chemie, 2022-10, Vol.153 (10), p.949-960

2022

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Proteome-wide subtractive approach to prioritize a hypothetical protein of XDR-Mycobacterium tuberculosis as potential drug target

Genes & Genomics, 2019, 41(11), , pp.1281-1292

2019

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Synthesis, characterization, biological screenings and molecular docking study of Organotin(IV) derivatives of 2,4-dichlorophenoxyacetic acid

Journal of molecular structure, 2019-03, Vol.1179, p.662-671

2019

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New triazinoindole bearing thiazole/oxazole analogues: Synthesis, α-amylase inhibitory potential and molecular docking study

Bioorganic chemistry, 2019-11, Vol.92, p.103284-103284, Article 103284

2019

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Synthesis of new arylhydrazide bearing Schiff bases/thiazolidinone: α-Amylase, urease activities and their molecular docking studies

Bioorganic chemistry, 2019-10, Vol.91, p.103112-103112, Article 103112

2019

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Isatin based thiosemicarbazide derivatives as potential inhibitor of α-glucosidase, synthesis and their molecular docking study

Journal of molecular structure, 2020-12, Vol.1222, p.128922, Article 128922

2020

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Synthesis of novel indazole derivatives as inhibitors of diabetics II along with molecular docking and simulation study

Journal of molecular structure, 2025-02, Vol.1322, p.140394, Article 140394

2025

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Synthesis, in vitro urease inhibitory potential and molecular docking study of Benzimidazole analogues

Bioorganic chemistry, 2019-08, Vol.89, p.103024-103024, Article 103024

2019

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Synthesis and Molecular Docking of New Bis‐Thiazolidinone‐Based Chalcone Analogs as Effective Inhibitors of Acetylcholinesterase and Butyrylcholinesterase

Chemistry & biodiversity, 2022-10, Vol.19 (10), p.e202200323-n/a

2022

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Blocking the major inflammatory pathways by newly synthesized thiadiazine derivatives via in-vivo, in-vitro and in-silico mechanism

Bioorganic chemistry, 2023-11, Vol.140, p.106760-106760, Article 106760

2023

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Subtractive proteomics and immunoinformatics approaches to explore Bartonella bacilliformis proteome (virulence factors) to design B and T cell multi-epitope subunit vaccine

Infection, genetics and evolution, 2020-11, Vol.85, p.104551-104551, Article 104551

2020

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Synthesis, molecular docking study and in vitro thymidine phosphorylase inhibitory potential of oxadiazole derivatives

Bioorganic chemistry, 2018-08, Vol.78, p.58-67

2018

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Antifungal and Antiproliferative Activity of Pistagremic Acid and Flavonoids Extracted from the Galls of Pistacia chinensis subsp. integerrima

Chemistry & biodiversity, 2024-02, Vol.21 (2), p.e202301815-n/a

2024

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Subtractive Genomics, Molecular Docking and Molecular Dynamics Simulation Revealed LpxC as a Potential Drug Target Against Multi-Drug Resistant Klebsiella pneumoniae

Interdisciplinary sciences : computational life sciences, 2019-09, Vol.11 (3), p.508-526

2019

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Computational analysis of benzofuran-2-carboxlic acids as potent Pim-1 kinase inhibitors

Pharmaceutical biology, 2014-09, Vol.52 (9), p.1170-1178

2014

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Synthesis, SAR elucidations and molecular docking study of newly designed isatin based oxadiazole analogs as potent inhibitors of thymidine phosphorylase

Bioorganic chemistry, 2018-09, Vol.79, p.323-333

2018

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Identification of potent inhibitors for chromodomain-helicase- DNA-binding protein 1-like through moleculardocking studies

Medicinal chemistry research, 2016-12, Vol.25 (12), p.2924-2939

2016

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Morpholine hydrazone scaffold： Synthesis, anticancer activity and docking studies

In silico identification of promiscuous scaffolds as potential inhibitors of 1-deoxy-d-xylulose 5-phosphate reductoisomerase for treatment of Falciparum malaria

Synthesis, biological evaluation and molecular docking study of benzimidazole derivatives as α-glucosidase inhibitors and anti-diabetes candidates

Cytotoxicity of Anchusa arvensis Against HepG-2 Cell Lines: Mechanistic and Computational Approaches

Identification of novel inhibitors for SARS-CoV-2 as therapeutic options using machine learning-based virtual screening, molecular docking and MD simulation

Synthesis, molecular docking and α-glucosidase inhibition of 5-aryl-2-(6′-nitrobenzofuran-2′-yl)-1,3,4-oxadiazoles

Nitazoxanide and azithromycin for the early treatment of COVID‐19: A multi‐spectroscopic, biochemical and computational drug–drug interaction study

Synthesis, in vitro alpha-glucosidase inhibitory potential of benzimidazole bearing bis-Schiff bases and their molecular docking study

Synthesis and evaluation of aryl aminomethylene substituted barbiturates and thiobarbiturates as novel α-amylase inhibitors and radical scavengers

Proteome-wide subtractive approach to prioritize a hypothetical protein of XDR-Mycobacterium tuberculosis as potential drug target

Synthesis, characterization, biological screenings and molecular docking study of Organotin(IV) derivatives of 2,4-dichlorophenoxyacetic acid

New triazinoindole bearing thiazole/oxazole analogues: Synthesis, α-amylase inhibitory potential and molecular docking study

Synthesis of new arylhydrazide bearing Schiff bases/thiazolidinone: α-Amylase, urease activities and their molecular docking studies

Isatin based thiosemicarbazide derivatives as potential inhibitor of α-glucosidase, synthesis and their molecular docking study

Synthesis of novel indazole derivatives as inhibitors of diabetics II along with molecular docking and simulation study

Synthesis, in vitro urease inhibitory potential and molecular docking study of Benzimidazole analogues

Synthesis and Molecular Docking of New Bis‐Thiazolidinone‐Based Chalcone Analogs as Effective Inhibitors of Acetylcholinesterase and Butyrylcholinesterase

Blocking the major inflammatory pathways by newly synthesized thiadiazine derivatives via in-vivo, in-vitro and in-silico mechanism

Subtractive proteomics and immunoinformatics approaches to explore Bartonella bacilliformis proteome (virulence factors) to design B and T cell multi-epitope subunit vaccine

Synthesis, molecular docking study and in vitro thymidine phosphorylase inhibitory potential of oxadiazole derivatives

Antifungal and Antiproliferative Activity of Pistagremic Acid and Flavonoids Extracted from the Galls of Pistacia chinensis subsp. integerrima

Subtractive Genomics, Molecular Docking and Molecular Dynamics Simulation Revealed LpxC as a Potential Drug Target Against Multi-Drug Resistant Klebsiella pneumoniae

Computational analysis of benzofuran-2-carboxlic acids as potent Pim-1 kinase inhibitors

Synthesis, SAR elucidations and molecular docking study of newly designed isatin based oxadiazole analogs as potent inhibitors of thymidine phosphorylase

Identification of potent inhibitors for chromodomain-helicase- DNA-binding protein 1-like through moleculardocking studies

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