Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 18/20 | 0.39 |
| ▸ | CTSD | P07339 | 1/20 | 0.36 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL13268492 | 0.99 | BACE1 (0.38) | BACE1CTSDBACE2 | |
| Formic Acid SCHEMBL13268456 | 0.95 | BACE1 (0.37) | BACE1CTSD | |
| SCHEMBL13268441 | 0.82 | BACE1 (0.44) | BACE1CTSDBACE2 | |
| SCHEMBL1983115 | 0.82 | BACE1 (0.45) | BACE1BACE2 | |
| Hydrochloric Acid SCHEMBL14732038 | 0.81 | BACE1 (0.43) | BACE1CTSDBACE2 | |
| SCHEMBL1980213 | 0.80 | BACE1 (0.43) | BACE1CTSDBACE2 | |
| SCHEMBL13278691 | 0.80 | BACE1 (0.38) | BACE1BACE2 | |
| SCHEMBL13268451 | 0.80 | BACE1 (0.38) | BACE1BACE2 | |
| Hydrochloric Acid SCHEMBL13268495 | 0.79 | BACE1 (0.37) | BACE1BACE2 | |
| Formic Acid SCHEMBL14732062 | 0.79 | BACE1 (0.42) | BACE1CTSDBACE2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2509965-A1 | 2-AMINO-5, 5-DIFLUORO-5, 6-DIHYDRO-4H-OXAZINES AS BACE 1 AND/OR BACE 2 INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2012-10-17 | — | — | EP | claimed |
| EP-2509965-A1 | 2-AMINO-5, 5-DIFLUORO-5, 6-DIHYDRO-4H-OXAZINES AS BACE 1 AND/OR BACE 2 INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2012-10-17 | — | — | EP | disclosed |