Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH2 | P05091 | 16/20 | 0.65 |
| ▸ | MAOA | P21397 | 9/20 | 0.65 |
| ▸ | MAOB | P27338 | 9/20 | 0.65 |
| ▸ | LSS | P48449 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL4746357 | 1.00 | ALDH2 (0.65) | ALDH2MAOAMAOBLSS | |
| SCHEMBL4745525 | 0.99 | ALDH2 (0.65) | ALDH2MAOAMAOBLSS | |
| SCHEMBL4741939 | 0.95 | ALDH2 (0.64) | ALDH2MAOAMAOBLSS | |
| SCHEMBL8478393 | 0.89 | ALDH2 (0.67) | ALDH2MAOAMAOBLSS | |
| SCHEMBL4896442 | 0.86 | ALDH2 (0.64) | ALDH2MAOAMAOBLSS | |
| SCHEMBL4746350 | 0.85 | ALDH2 (0.52) | ALDH2MAOAMAOBLSS | |
| SCHEMBL4745671 | 0.80 | PDK1 (0.60) | ALDH2 | |
| SCHEMBL25225097 | 0.80 | ALDH2 (0.82) | ALDH2MAOAMAOB | |
| SCHEMBL4744391 | 0.80 | HRH3 (0.57) | — | |
| SCHEMBL740753 | 0.79 | ALDH2 (0.80) | ALDH2MAOAMAOB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008107321-A1 | HETEROCYCLIC COMPOUNDS USED AS ANTI-NEOPLASIC AGENTS OR CELL PROLIFERATION INHIBITORS | CEREP (FR) | 2008-09-12 | — | — | WO | disclosed |