Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 18/20 | 0.34 |
| ▸ | BACE2 | Q9Y5Z0 | 17/20 | 0.34 |
| ▸ | CTSD | P07339 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL991134 | 0.89 | BACE1 (0.39) | BACE1BACE2 | |
| SCHEMBL990487 | 0.88 | ALDH1A1 (0.33) | BACE1BACE2 | |
| SCHEMBL990489 | 0.88 | ALDH1A1 (0.33) | BACE1BACE2 | |
| SCHEMBL8515730 | 0.83 | BACE1 (0.38) | BACE1BACE2 | |
| SCHEMBL991283 | 0.81 | BACE1 (0.42) | BACE1BACE2 | |
| SCHEMBL991135 | 0.81 | BACE1 (0.38) | BACE1BACE2 | |
| SCHEMBL6920051 | 0.80 | BACE1 (0.37) | BACE1BACE2 | |
| SCHEMBL15327016 | 0.76 | BACE1 (0.49) | BACE1BACE2CTSD | |
| SCHEMBL11918207 | 0.76 | BACE1 (0.40) | BACE1BACE2 | |
| SCHEMBL11901104 | 0.75 | BACE1 (0.41) | 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 |