Multicomplex Pharmacophore Modeling of Estrogen Receptors Suggests the Probable Repurposing of Procaterol as an Antiproliferative Agent Against Breast Cancer Cells. [PDF]
Int J Mol SciVazquez-Mendoza LH +6 more
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A 5-Br-1-Propylisatin Derivative as a Promising BRD9 Ligand: Insights from Computational and STD NMR Investigation. [PDF]
MoleculesGazzillo E +5 more
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Explore Pharmacophore Diversity... [PDF]
Chemical & Engineering News Archive, 1995 openaire +1 more source
Selective phosphoinositide 3-kinase inhibitors and implication in diabetic retinopathy as pharmacological tools. [PDF]
Front PharmacolBonaccorso C +6 more
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HYG-mol: An Interpretable Multimodal Hypergraph Framework for Molecular Property Prediction. [PDF]
Comput Struct Biotechnol JMa J, Yang Q, Zhang L, Liu H, Zheng Y.
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Decoding the Benzaldehyde Pharmacophore: Structural Determinants for Enhancing Antibacterial Efficacy and Food Safety. [PDF]
FoodsArunachalam K +4 more
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Development of DHODH inhibitors incorporating virtual screening, pharmacophore modeling, fragment-based optimization methods, ADMET, molecular docking, molecular dynamics, PCA analysis, and free energy landscape. [PDF]
PLoS OneWang Q, Xu YH, Jiang H, Deng B, Liang Z.
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Efficacious Anti-Cancer Drugs Targeting Nicotinamide <i>N</i>-Methyltransferase (NNMT) in Cultured Human Oral Squamous Cell Carcinoma (OSCC). [PDF]
Pharmaceuticals (Basel)Maloney B +9 more
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In silico-driven identification of potent CDK9 inhibitors through bioisosteric replacement and multi-stage virtual screening. [PDF]
Sci RepAmorim J +5 more
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