Fig. 6: The chemical structures of five MMCLKin-identified compounds and the positive control, along with their inhibition rates at a concentration of 10 μM and their IC₅₀ values. | Nature Communications

Fig. 6: The chemical structures of five MMCLKin-identified compounds and the positive control, along with their inhibition rates at a concentration of 10 μM and their IC₅₀ values.

From: Enhancing kinase-inhibitor activity and selectivity prediction through contrastive learning

Fig. 6: The chemical structures of five MMCLKin-identified compounds and the positive control, along with their inhibition rates at a concentration of 10 μM and their IC₅₀ values.

a Chemical structures of five candidate compounds exhibiting greater than 50% inhibition at 10 \({{{\rm{\mu }}}}{{{\rm{M}}}}\) and the positive control. b Inhibitory ratio of five candidate compounds and the positive control at 10 \({{{\rm{\mu }}}}{{{\rm{M}}}}\) concentration. Three independent replications of each method were performed (n = 3). Data are expressed as mean ± SD. c IC₅₀ values of five candidate compounds and the positive control against LRRK2 G2019S mutant. Three independent replications of each method were performed (n = 3). Data are expressed as mean ± SD. Source data are provided as a Source Data file.

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