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High-Priority Promiscuity Cliffs From Pubchem

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Zenodo2020-09-18 更新2026-05-25 收录
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A representative sample of 278 high-priority promiscuity cliffs identified from PubChem is provided. These promiscuity cliffs were formed by pairs of structurally analogous compounds with a difference in promiscuity degrees of at last 20 targets. These compounds were tested in at least 300 shared primary assays (SA) and showed assay similarity (AS) and assay frequency ratio (AFR) values of at least 0.85. A README file is also given.

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Zenodo
创建时间:
2017-02-21
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