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Figure 1

From: Predicting protein-ligand interactions based on bow-pharmacological space and Bayesian additive regression trees

Figure 1

Bow-pharmacological space. (a) The bow-pharmacological space spans three subspaces: protein space in blue, ligand space in green, and interaction space in pink. Filled circles represent proteins and triangles represent ligands. Protein–ligand pairs of known interactions from published databases are denoted as “known” whereas those not curated in the databases are denoted as “new.” Solid lines indicate known interactions in the interaction space while dashed lines illustrate three kinds of unknown interactions (① unknown protein with known ligand, ② known protein with unknown ligand, ③ unknown protein with unknown ligand). (b) Features in bow-pharmacological space.

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