Bioactive compounds with no structural analogs (high-confidence activity data)

<p>A set of 52,815 unique bioactive compounds (human targets, high-confidence activity data) with no structural analogs with high-confidence activity data was extracted from ChEMBL. For each compound the ChEMBL compound ID (CHEMBLID_Compound) and high-confidence target annotation(s) (CHEMBLID_Targets) are provided. The data set was generated as a part of an analysis&nbsp;to be published in &#39;Medicinal Chemistry Communications&#39;. &nbsp; &nbsp; &nbsp;&nbsp;</p>