Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL19182979 | 1.00 | HSP90AA1 (1.00) | HSP90AA1PDK1 | |
| SCHEMBL30474354 | 0.86 | HSP90AA1 (1.00) | HSP90AA1PDK1 | |
| SCHEMBL20677863 | 0.86 | HSP90AA1 (1.00) | HSP90AA1PDK1 | |
| SCHEMBL20677878 | 0.85 | HSP90AA1 (1.00) | HSP90AA1PDK1 | |
| SCHEMBL30474395 | 0.85 | HSP90AA1 (1.00) | HSP90AA1PDK1 | |
| SCHEMBL20677851 | 0.81 | HSP90AA1 (1.00) | HSP90AA1PDK1 | |
| SCHEMBL20677850 | 0.81 | HSP90AA1 (0.74) | HSP90AA1PDK1 | |
| SCHEMBL484983 | 0.80 | HSP90AA1 (0.66) | HSP90AA1 | |
| SCHEMBL20677835 | 0.79 | HSP90AA1 (1.00) | HSP90AA1PDK1 | |
| SCHEMBL20677870 | 0.79 | HSP90AA1 (0.78) | HSP90AA1PDK1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112661661-B | Compounds having HSP90 inhibitory activity or pharmaceutically acceptable salts thereof and medical use thereof | 恩科森株式会社 | 2023-06-27 | — | — | CN | disclosed |