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. 2021 Aug 5;1(10):1612–1620. doi: 10.1021/jacsau.1c00246

Figure 4.

Figure 4

Multistep retrosynthesis predictions by LocalRetro for (a) lenalidomide, (b) salmeterol, (c) a 5-HT6 receptor ligand, (d) a DDR1 kinase inhibitor INS015_037, and (e) another DDR1 kinase inhibitor INS015_032. The reaction center and the atom and bond transformations are highlighted in different colors at different reaction steps. Out of total 25 individual predicted synthesis steps considered, 19 steps were predicted correctly within the rank-2 predictions.