Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | HCRTR1 | O43613 | 18/20 | 0.54 |
| ▸ | HCRTR2 | O43614 | 11/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL934699 | 0.95 | CYP3A4 (0.62) | CYP3A4HCRTR1HCRTR2 | |
| SCHEMBL935121 | 0.95 | CYP3A4 (0.62) | CYP3A4HCRTR1HCRTR2 | |
| SCHEMBL934698 | 0.95 | CYP3A4 (0.62) | CYP3A4HCRTR1HCRTR2 | |
| SCHEMBL934041 | 0.92 | CYP3A4 (0.67) | CYP3A4HCRTR1HCRTR2 | |
| SCHEMBL935046 | 0.92 | CYP3A4 (0.67) | CYP3A4HCRTR1HCRTR2 | |
| SCHEMBL934043 | 0.92 | CYP3A4 (0.67) | CYP3A4HCRTR1HCRTR2 | |
| SCHEMBL934571 | 0.92 | HCRTR1 (0.59) | CYP3A4HCRTR1HCRTR2 | |
| SCHEMBL935275 | 0.92 | HCRTR1 (0.59) | CYP3A4HCRTR1HCRTR2 | |
| SCHEMBL951318 | 0.90 | HCRTR1 (0.58) | CYP3A4HCRTR1HCRTR2 | |
| SCHEMBL933525 | 0.89 | CYP3A4 (0.62) | CYP3A4HCRTR1HCRTR2 |
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-2275421-A1 | Spiro amino compounds suitable for the treatment of inter alia sleep disorders and drug addiction | Rottapharm S.p.A. (IT) | 2011-01-19 | — | — | EP | disclosed |