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. 2021 Mar 19;12:1760. doi: 10.1038/s41467-021-22022-5

Fig. 1. Overall workflow integrating computational prediction of target compounds, pathways, and enzymes with experimental validation.

Fig. 1

a Applied design-build-test cycle. b Computational workflow. Circles represent compounds, edges represent biotransformations. Green is used to designate known biological reactions and compounds and blue circles are compounds from the chemical space without specific biological annotation. Red circles show compounds selected for their popularity in scientific literature and in the patent landscape, and red edges represent their corresponding biosynthesis pathways.