Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL26962164 | 0.88 | PDK2 (0.33) | PDK2 | |
| SCHEMBL26961932 | 0.83 | NPY1R (0.32) | PDK2 | |
| SCHEMBL26961807 | 0.80 | SMN1; SMN2 (0.34) | PDK2 | |
| SCHEMBL26961929 | 0.80 | PDK2 (0.34) | PDK2 | |
| SCHEMBL26961787 | 0.79 | XIAP (0.32) | — | |
| SCHEMBL26961749 | 0.79 | AKT1 (0.33) | — | |
| SCHEMBL26961717 | 0.79 | HDAC6 (0.34) | — | |
| SCHEMBL26961880 | 0.79 | KCNN4 (0.33) | PDK2 | |
| SCHEMBL26961829 | 0.79 | XIAP (0.32) | — | |
| SCHEMBL31628294 | 0.78 | P2RY14 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4291558-A1 | BICYCLIC TETRAHYDROAZEPINE DERIVATIVES FOR THE TREATMENT OF CANCER | F. Hoffmann-La Roche AG (CH) | 2023-12-20 | — | — | EP | disclosed |