ChEMBLSpace--a graphical explorer of the chemogenomic space covered by the ChEMBL database.

Fechner, Nikolas; Papadatos, George; Evans, David; Morphy, John Richard; Brewerton, Suzanne Clare; Thorner, David; Bodkin, Michael · Bioinformatics · 2013

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Abstract

The ChEMBLSpace graphical explorer enables the identification of compounds from the ChEMBL database, which exhibit a desirable polypharmacology profile. This profile can be predefined or created iteratively, and the tool can be extended to other data sources.

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