Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 17/20 | 0.47 |
| ▸ | HCRTR1 | O43613 | 16/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9957079 | 0.89 | HCRTR1 (0.57) | HCRTR2HCRTR1 | |
| SCHEMBL9956544 | 0.89 | HCRTR1 (0.57) | HCRTR2HCRTR1 | |
| SCHEMBL9957552 | 0.89 | HCRTR1 (0.57) | HCRTR2HCRTR1 | |
| SCHEMBL9957554 | 0.89 | HCRTR1 (0.57) | HCRTR2HCRTR1 | |
| SCHEMBL9957704 | 0.89 | HCRTR2 (0.52) | HCRTR2HCRTR1 | |
| SCHEMBL9957269 | 0.87 | HCRTR2 (0.41) | HCRTR2HCRTR1CYP3A4 | |
| SCHEMBL9955407 | 0.86 | HCRTR1 (0.59) | HCRTR2HCRTR1 | |
| SCHEMBL9954146 | 0.86 | HCRTR1 (0.59) | HCRTR2HCRTR1 | |
| SCHEMBL9955441 | 0.86 | HCRTR1 (0.59) | HCRTR2HCRTR1 | |
| SCHEMBL9957037 | 0.83 | HCRTR1 (0.45) | HCRTR2HCRTR1 |
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-2012085852-A1 | 3,8-DIAZA-BICYCLO[4.2.0]OCT-8-YL AMIDES | ACTELION PHARMACEUTICALS LTD (CH) | 2012-06-28 | — | — | WO | disclosed |