Redundancy in two major compound databases.

Dimitar Yonchev,Dilyana Dimova,Dagmar Stumpfe,Martin Vogt,Jürgen Bajorath

Drug Discovery Today（2018）

引用 9|浏览22

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摘要

•Public compound databases are of high relevance for drug discovery.•Crosstalk between databases is desirable but also leads to redundancy.•ChEMBL and PubChem contain many shared compounds and activity records.•Data exchange requires a high level of transparency.

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关键词

Compounds,activity data,data exchange,pharmaceutical research,public databases,redundancy

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