Other datasets exist that map protein 3D structure (or sequence) to ligand activity without crystal poses, but none have the scope of BigBind. DAVIS, KIBA, and KinCo, for instance, are limited to kinases. Benchmarking datasets such as DUD-E, DEKOIS, and LIT-PCBA 30 also contain activity data without crystal poses, but these are designed to benchmark rather than train SBVS models. As such, they do not contain the same breadth of data as BigBind, and the data is highly imbalanced toward inactive molecules.