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Samima Khatun
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Imidazopyridine, a promising scaffold with potential medicinal applications and structural activity relationship (SAR): recent advances
S Khatun, A Singh, GN Bader, FA Sofi
Journal of Biomolecular Structure and Dynamics 40 (24), 14279-14302, 2022
252022
Reactive metabolites from thiazole-containing drugs: Quantum chemical insights into biotransformation and toxicity
CK Jaladanki, S Khatun, H Gohlke, PV Bharatam
Chemical research in toxicology 34 (6), 1503-1517, 2021
192021
Are inhibitors of histone deacetylase 8 (HDAC8) effective in hematological cancers especially acute myeloid leukemia (AML) and acute lymphoblastic leukemia (ALL)?
SA Amin, S Khatun, S Gayen, S Das, T Jha
European Journal of Medicinal Chemistry, 115594, 2023
72023
A detail survey and analysis of selectivity criteria for indole-based histone deacetylase 8 (HDAC8) inhibitors
M Moinul, SA Amin, S Khatun, S Das, T Jha, S Gayen
Journal of Molecular Structure 1271, 133967, 2023
72023
Recent trends in fragment-based anticancer drug design strategies against different targets: A mini-review
M Moinul, S Khatun, SA Amin, T Jha, S Gayen
Biochemical Pharmacology 206, 115301, 2022
62022
Binary quantitative activity-activity relationship (QAAR) studies to explore selective HDAC8 inhibitors: In light of mathematical models, DFT-based calculation and molecular …
SA Amin, J Kumar, S Khatun, S Das, IA Qureshi, T Jha, S Gayen
Journal of Molecular Structure 1260, 132833, 2022
62022
Identification of structural fingerprints among natural inhibitors of HDAC1 to accelerate nature-inspired drug discovery in cancer epigenetics
S Sardar, Jyotisha, SA Amin, S Khatun, IA Qureshi, UK Patil, T Jha, ...
Journal of Biomolecular Structure and Dynamics, 1-15, 2023
22023
In Silico Discovery of Class IIb HDAC Inhibitors: The State of Art
S Khatun, SA Amin, S Gayen, T Jha
Current Trends in Computational Modeling for Drug Discovery, 25-55, 2023
12023
Quasi-SMILES as a Tool for Peptide QSAR Modelling
M Moinul, S Khatun, S Abdul Amin, T Jha, S Gayen
QSPR/QSAR Analysis Using SMILES and Quasi-SMILES, 269-294, 2023
12023
Remdesivir: Mechanism of Metabolic Conversion from Prodrug to Drug
S Kapoor, G Dubey, S Khatun, PV Bharatam
Current Drug Metabolism 23 (1), 73-81, 2022
12022
HDAC9 as a Privileged Target: Reviewing its Role in Different Diseases and Structure-activity Relationships (SARs) of its Inhibitors
T Das, S Khatun, T Jha, S Gayen
Mini Reviews in Medicinal Chemistry 24 (7), 767-784, 2024
2024
Advances in structure-activity relationships of HDAC inhibitors as HIV latency-reversing agents
S Khatun, SA Amin, D Choudhury, B Chowdhury, T Jha, S Gayen
Expert Opinion on Drug Discovery, 1-16, 2024
2024
11 Modeling Inhibitors
S Khatun, SA Amin, S Banerjee, S Gayen, T Jha
Modeling Inhibitors of Matrix Metalloproteinases, 368, 2023
2023
Reactive Metabolites from Thiazole-containing Drugs: Quantum Chemical Insights into Biotransformation and Toxicity
PVB S Khatun, CK Jaladanki
https://t3-1.conventus-hetzner.de/fileadmin/GPTS_2021_Abstract_booklet.pdf, 2021
2021
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