Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 18/20 | 0.55 |
| ▸ | BACE2 | Q9Y5Z0 | 6/20 | 0.54 |
| ▸ | CTSD | P07339 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7861694 | 1.00 | BACE1 (0.55) | BACE1BACE2CTSD | |
| SCHEMBL2888444 | 0.80 | BACE1 (0.40) | BACE1BACE2 | |
| SCHEMBL2888441 | 0.80 | BACE1 (0.36) | BACE1BACE2 | |
| SCHEMBL2888440 | 0.80 | BACE1 (0.36) | BACE1BACE2 | |
| SCHEMBL7859564 | 0.75 | BACE1 (0.57) | BACE1BACE2 | |
| SCHEMBL297844 | 0.75 | BACE1 (0.57) | BACE1BACE2 | |
| SCHEMBL287173 | 0.74 | BACE2 (0.68) | BACE1BACE2CTSD | |
| SCHEMBL287519 | 0.74 | BACE1 (0.73) | BACE1BACE2 | |
| SCHEMBL12301385 | 0.74 | BACE1 (0.73) | BACE1BACE2 | |
| SCHEMBL6919713 | 0.72 | BACE1 (0.71) | BACE1BACE2 |
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-2427437-A1 | DIHYDROPYRIMIDINONES FOR USE AS BACE2 INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2012-03-14 | — | — | EP | claimed |
| EP-2427437-A1 | DIHYDROPYRIMIDINONES FOR USE AS BACE2 INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2012-03-14 | — | — | EP | disclosed |