#drug discovery — Friday, July 31, 2026 (3 items)
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AI-driven discovery and validation of a GIPC1 PDZ domain inhibitor for pancreatic ductal adenocarcinoma.
(linkinghub.elsevier.com)
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Cell Reports 2026-07-31 | #drug discovery #pancreatic cancer #protein-protein interaction #chemoresistance #computational modeling | |
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A trifluoromethyl quinazoline inhibits hepatocellular carcinoma proliferation through HDAC1 binding and multi-target mechanisms.
(linkinghub.elsevier.com)
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iScience 2026-07-31 | #hepatocellular carcinoma #apoptosis #drug discovery #anticancer #hdac-inhibition | |
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Activity-cliff awareness enables robust graph learning for molecular property prediction.
(nature.com)
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Nature Communications 2026-07-31 | #qsar #molecular-property-prediction #machine learning #graph-neural-networks #drug discovery |