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PubPharm (33)
1
Fragment-based discovery of new potential DNMT1 inhibitors integrating multiple pharmacophore modeling, 3D-QSAR, virtual screening, molecular docking, ADME, and molecular dynamics simulation approaches
enthalten in:
Molecular diversity
| 2024
von
Lanka, G.
|
Banerjee, S.
|
Adhikari, N.
| +1
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2
An assessment of crucial structural contributors of HDAC6 inhibitors through fragment-based non-linear pattern recognition and molecular dynamics simulation approaches
enthalten in:
Computational biology and chemistry
| 2024
von
Banerjee, S.
|
Jana, S.
|
Jha, T.
| +2
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3
A combined ligand-based and structure-based in silico molecular modeling approach to pinpoint the key structural attributes of hydroxamate derivatives as promising meprin β inhibitors
enthalten in:
Journal of biomolecular structure & dynamics
| 2024
von
Jana, S.
|
Banerjee, S.
|
Baidya, S.
| +3
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4
Fragment-based investigation of thiourea derivatives as VEGFR-2 inhibitors : a cross-validated approach of ligand-based and structure-based molecular modeling studies
enthalten in:
Journal of biomolecular structure & dynamics
| 2024
von
Banerjee, S.
|
Kejriwal, S.
|
Ghosh, B.
| +3
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5
A fragment-based exploration of diverse MMP-9 inhibitors through classification-dependent structural assessment
enthalten in:
Journal of molecular graphics & modelling
| 2024
von
Baidya, S.
|
Banerjee, S.
|
Ghosh, B.
| +2
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6
An updated patent review of matrix metalloproteinase (MMP) inhibitors (2021-present)
enthalten in:
Expert opinion on therapeutic patents
| 2023
von
Banerjee, S.
|
Baidya, S.
|
Adhikari, N.
| +1
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7
Pharmacophore-based virtual screening, 3D QSAR, Docking, ADMET, and MD simulation studies : An in silico perspective for the identification of new potential HDAC3 inhibitors
enthalten in:
Computers in biology and medicine
| 2023
von
Lanka, G.
|
Begum, D.
|
Banerjee, S.
| +3
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8
Selective HDAC3 Inhibitors with Potent In Vivo Antitumor Efficacy against Triple-Negative Breast Cancer
enthalten in:
Journal of medicinal chemistry
| 2023
von
Pulya, S.
|
Himaja, A.
|
Paul, M.
| +6
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9
Fragment-based structural exploration and chemico-biological interaction study of HDAC3 inhibitors through non-linear pattern recognition, chemical space, and binding mode of interaction analysis
enthalten in:
Journal of biomolecular structure & dynamics
| 2023
von
Banerjee, S.
|
Dumawat, S.
|
Jha, T.
| +3
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10
Development and validation of machine learning models for the prediction of SH-2 containing protein tyrosine phosphatase 2 inhibitors
enthalten in:
Molecular diversity
| 2023
von
Adhikari, N.
|
Ayyannan, S.
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Erscheinungsjahr: 2020-2029
Medienart
33
Aufsätze
33
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E-Ressourcen
Zeitschriftentitel
9
Journal of biomolecular structure & dynamics
5
European journal of medicinal chemistry
4
Future medicinal chemistry
3
Journal of medicinal chemistry
2
Bioorganic chemistry
2
Journal of molecular structure
2
Molecular diversity
1
Computational biology and chemistry
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Computers in biology and medicine
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Current topics in medicinal chemistry
1
Expert opinion on therapeutic patents
1
Journal of molecular graphics & modelling
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Pharmacological research
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Thema
30
Journal Article
10
Antineoplastic Agents
10
Research Support, Non-U.S. Gov't
9
EC 3.5.1.98
9
Histone Deacetylase Inhibitors
9
QSAR
9
Review
8
Histone Deacetylases
5
Matrix Metalloproteinase Inhibitors
5
histone deacetylase 3
4
Cancer
4
HDAC3 inhibitor
4
cancer
3
Bayesian classification
3
HDAC8
3
HQSAR
3
ROS
2
Anticancer agent
2
Apoptosis
2
Benzamides
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Erscheinungszeitraum
2020-
5
2024
8
2023
4
2022
8
2021
8
2020
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