Design, Synthesis and Molecular Docking Studies of Novel Indole–Isoxazole–Triazole Conjugates as Potent Antibacterial Agents

Design, synthesis, biological assessment and molecular docking studies of some new 2-Thioxo-2,3-dihydropyrimidin-4(1H)-ones as potential anticancer and antibacterial agents

Journal of Molecular Structure ◽

10.1016/j.molstruc.2020.129014 ◽

2021 ◽

Vol 1225 ◽

pp. 129014

Author(s):

Abd-Allah Sh El-Etrawy ◽

Farag F. Sherbiny

Keyword(s):

Molecular Docking ◽

Antibacterial Agents ◽

Docking Studies ◽

Biological Assessment ◽

Design Synthesis ◽

Design, synthesis, spectral characterization and molecular docking studies of novel pyranoquinolinyl dihydropyridine carboxylates as potential antibacterial agents including Vibrio cholerae with minimal cytotoxity towards fibroblast cell line (L-929)

Bioorganic Chemistry ◽

10.1016/j.bioorg.2020.104582 ◽

2021 ◽

Vol 107 ◽

pp. 104582

Author(s):

G. Lavanya ◽

C.J. Magesh ◽

K. Venkatapathy ◽

P.T. Perumal ◽

S. Prema

Keyword(s):

Molecular Docking ◽

Cell Line ◽

Vibrio Cholerae ◽

Antibacterial Agents ◽

Fibroblast Cell ◽

Docking Studies ◽

Spectral Characterization ◽

Fibroblast Cell Line ◽

Design Synthesis ◽

Folic acid-sulfonamide conjugates as antibacterial agents: design, synthesis and molecular docking studies

RSC Advances ◽

10.1039/d0ra09051d ◽

2020 ◽

Vol 10 (70) ◽

pp. 42983-42992

Author(s):

Shabnam Shahzad ◽

Muhammad Abdul Qadir ◽

Mahmood Ahmed ◽

Saghir Ahmad ◽

Muhammad Jadoon Khan ◽

...

Keyword(s):

Molecular Docking ◽

Folic Acid ◽

Dihydrofolate Reductase ◽

Antibacterial Agents ◽

Docking Studies ◽

Design Synthesis ◽

Dhfr Inhibitors

Dihydrofolate reductase (DHFR) inhibitors, as antibacterial agents, contain pyrimidine, pteridine, and azine moieties among many other scaffolds.

3D-QSAR modeling and molecular docking studies on a series of triazole analogues as antibacterial agents

Журнал структурной химии ◽

10.26902/jsc20180705 ◽

2018 ◽

Vol 59 (7) ◽

Keyword(s):

Molecular Docking ◽

Antibacterial Agents ◽

3D Qsar ◽

Docking Studies ◽

Qsar Modeling ◽

Design, synthesis, crystal structure, molecular docking studies of some diorganotin(IV) complexes derived from the piperonylic hydrazide Schiff base ligands as cytotoxic agents

Journal of Molecular Structure ◽

10.1016/j.molstruc.2021.129992 ◽

2021 ◽

Vol 1232 ◽

pp. 129992

Author(s):

Jai Devi ◽

Jyoti Yadav ◽

Kashmiri Lal ◽

Nikhil Kumar ◽

Avijit Kumar Paul ◽

...

Keyword(s):

Crystal Structure ◽

Schiff Base ◽

Molecular Docking ◽

Docking Studies ◽

Cytotoxic Agents ◽

Schiff Base Ligands ◽

Design Synthesis ◽

Design, synthesis and molecular docking studies of thymol based 1,2,3-triazole hybrids as thymidylate synthase inhibitors and apoptosis inducers against breast cancer cells

Bioorganic & Medicinal Chemistry ◽

10.1016/j.bmc.2021.116136 ◽

2021 ◽

pp. 116136

Author(s):

Mohammad Mahboob Alam ◽

Azizah M. Malebari ◽

Syed Nazreen ◽

Thikryat Neamatallah ◽

Abdulraheem SA Almalki ◽

...

Keyword(s):

Breast Cancer ◽

Molecular Docking ◽

Cancer Cells ◽

Thymidylate Synthase ◽

Breast Cancer Cells ◽

Docking Studies ◽

Design Synthesis ◽

Thymidylate Synthase Inhibitors

Design, Synthesis and molecular docking studies of new Azomethine derivatives as promising anti-inflammatory agents

Bioorganic Chemistry ◽

10.1016/j.bioorg.2021.105595 ◽

2022 ◽

pp. 105595

Author(s):

Sulaksha R. Desai ◽

Vidya G. Desai ◽

Raghuvir R. Pissurlenkar

Keyword(s):

Molecular Docking ◽

Docking Studies ◽

Design Synthesis ◽

Anti Inflammatory

Design, synthesis, cytotoxicity, HuTopoIIα inhibitory activity and molecular docking studies of pyrazole derivatives as potential anticancer agents

Bioorganic Chemistry ◽

10.1016/j.bioorg.2016.10.001 ◽

2016 ◽

Vol 69 ◽

pp. 77-90 ◽

Cited By ~ 21

Author(s):

Raquib Alam ◽

Divya Wahi ◽

Raja Singh ◽

Devapriya Sinha ◽

Vibha Tandon ◽

...

Keyword(s):

Molecular Docking ◽

Anticancer Agents ◽

Inhibitory Activity ◽

Docking Studies ◽

Pyrazole Derivatives ◽

Design Synthesis ◽

Indazoles as potential c-met inhibitors: Design, synthesis and molecular docking studies

European Journal of Medicinal Chemistry ◽

10.1016/j.ejmech.2013.04.004 ◽

2013 ◽

Vol 65 ◽

pp. 112-118 ◽

Cited By ~ 21

Author(s):

Lianbao Ye ◽

Xiaomin Ou ◽

Yuanxin Tian ◽

Bangwei Yu ◽

Yan Luo ◽

...

Keyword(s):

Molecular Docking ◽

Docking Studies ◽

Design Synthesis ◽

1,2,4-Triazole-based benzothiazole/benzoxazole derivatives: Design, synthesis, p38α MAP kinase inhibition, anti-inflammatory activity and molecular docking studies

Bioorganic Chemistry ◽

10.1016/j.bioorg.2018.09.015 ◽

2018 ◽

Vol 81 ◽

pp. 630-641 ◽

Cited By ~ 16

Author(s):

Sana Tariq ◽

Payal Kamboj ◽

Ozair Alam ◽

Mohd. Amir

Keyword(s):

Molecular Docking ◽

Map Kinase ◽

Docking Studies ◽

Inflammatory Activity ◽

Kinase Inhibition ◽

Design Synthesis ◽

Anti Inflammatory ◽

P38α Map Kinase