Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8778955 | 0.84 | AR (0.33) | — | |
| SCHEMBL8778968 | 0.80 | MEN1 (0.36) | ADRA2ANOTUM | |
| SCHEMBL8779060 | 0.77 | KDM1A (0.37) | ADRA2A | |
| SCHEMBL8779056 | 0.73 | F7 (0.39) | — | |
| SCHEMBL8778969 | 0.72 | KDM1A (0.34) | — | |
| SCHEMBL8779058 | 0.70 | METAP1 (0.40) | — | |
| SCHEMBL8779032 | 0.65 | AR (0.33) | — | |
| SCHEMBL8779076 | 0.63 | PNMT (0.34) | ADRA2A | |
| SCHEMBL7815325 | 0.62 | MEN1 (0.49) | NOTUMALDH1A1 | |
| SCHEMBL2256507 | 0.61 | MEN1 (0.52) | NOTUMALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0606661-B1 | Octahydrophenanthrene derivatives and their use as NMDA-Antagonists | HOFFMANN LA ROCHE (CH) | 1997-03-12 | — | — | EP | disclosed |
| US-5385947-A | For prevention of nerve damage due to reduction of blood or oxygen supplies | HOFFMANN-LA ROCHE INC. (US) | 1995-01-31 | — | — | US | disclosed |
| EP-0606661-A1 | Octahydrophenanthrene derivatives and their use as NMDA-Antagonists | F. HOFFMANN-LA ROCHE AG (CH) | 1994-07-20 | — | — | EP | disclosed |