Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 18/20 | 0.51 |
| ▸ | BACE2 | Q9Y5Z0 | 6/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8516737 | 0.86 | BACE1 (0.55) | BACE1BACE2CYP2D6 | |
| SCHEMBL990426 | 0.86 | BACE1 (0.63) | BACE1BACE2CYP2D6 | |
| SCHEMBL6920108 | 0.85 | BACE1 (0.52) | BACE1BACE2CYP2D6 | |
| SCHEMBL991255 | 0.83 | BACE1 (0.54) | BACE1BACE2 | |
| SCHEMBL8515016 | 0.83 | BACE1 (0.55) | BACE1BACE2 | |
| SCHEMBL990549 | 0.82 | BACE1 (0.57) | BACE1BACE2 | |
| SCHEMBL990605 | 0.80 | BACE1 (0.61) | BACE1BACE2CYP2D6 | |
| SCHEMBL11913736 | 0.79 | BACE1 (0.60) | BACE1BACE2 | |
| SCHEMBL991283 | 0.79 | BACE1 (0.42) | BACE1BACE2 | |
| SCHEMBL990539 | 0.78 | BACE1 (0.37) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011009897-A1 | FUSED AMINODIHYDROPYRIMIDONE DERIVATIVES | EISAI R&D MANAGEMENT CO., LTD (JP) | 2011-01-27 | — | — | WO | disclosed |