Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.61 |
| ▸ | BACE2 | Q9Y5Z0 | 8/20 | 0.61 |
| ▸ | APP | P05067 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1979859 | 0.93 | BACE1 (0.61) | BACE1CYP2D6BACE2 | |
| SCHEMBL1978595 | 0.89 | BACE1 (0.60) | BACE1BACE2 | |
| SCHEMBL1978549 | 0.87 | BACE1 (0.67) | BACE1CYP2D6BACE2APP | |
| SCHEMBL1978632 | 0.83 | BACE1 (0.53) | BACE1CYP2D6BACE2 | |
| SCHEMBL1979164 | 0.83 | BACE1 (0.59) | BACE1BACE2 | |
| SCHEMBL1979403 | 0.81 | BACE1 (0.59) | BACE1CYP2D6BACE2APP | |
| SCHEMBL1978950 | 0.80 | BACE1 (0.61) | BACE1BACE2APP | |
| SCHEMBL1980301 | 0.79 | BACE1 (0.77) | BACE1CYP2D6BACE2APP | |
| SCHEMBL1978958 | 0.79 | BACE1 (0.48) | BACE1BACE2APP | |
| SCHEMBL15145757 | 0.77 | BACE1 (0.66) | BACE1CYP2D6BACE2APP |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011070029-A1 | AMINO OXAZINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-06-16 | — | — | WO | claimed |
| EP-2509966-A1 | AMINO OXAZINE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2012-10-17 | — | — | EP | disclosed |
| WO-2011070029-A1 | AMINO OXAZINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-06-16 | — | — | WO | disclosed |