Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.33 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.31 |
| ▸ | BDKRB1 | P46663 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL26961893 | 0.96 | NPY1R (0.31) | — | |
| SCHEMBL26961877 | 0.93 | BDKRB1 (0.33) | BDKRB1 | |
| SCHEMBL26961668 | 0.90 | NPY1R (0.30) | — | |
| SCHEMBL26961689 | 0.88 | KCNH2 (0.33) | KCNH2SCN5ASCN9ABDKRB1 | |
| SCHEMBL26961726 | 0.88 | KCNH2 (0.33) | KCNH2SCN5ASCN9ABDKRB1 | |
| SCHEMBL29796890 | 0.88 | KCNH2 (0.33) | KCNH2SCN5ASCN9ABDKRB1 | |
| SCHEMBL26961836 | 0.86 | KCNN4 (0.33) | KCNN4 | |
| SCHEMBL29796854 | 0.86 | KCNN4 (0.33) | KCNN4 | |
| SCHEMBL29796709 | 0.84 | SRC (0.31) | BDKRB1 | |
| SCHEMBL26961876 | 0.84 | SRC (0.31) | BDKRB1 |
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 |