Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.41 |
| ▸ | CTSD | P07339 | 2/20 | 0.38 |
| ▸ | BACE2 | Q9Y5Z0 | 2/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4941398 | 0.85 | BCHE (0.39) | BACE1 | |
| SCHEMBL2021293 | 0.84 | BCHE (0.37) | BACE1 | |
| SCHEMBL4944393 | 0.77 | BCHE (0.38) | BACE1 | |
| SCHEMBL2022746 | 0.74 | BACE1 (0.41) | BACE1BACE2 | |
| SCHEMBL2021294 | 0.73 | BACE1 (0.41) | BACE1BACE2 | |
| SCHEMBL838354 | 0.72 | KDM4E (0.40) | BACE1 | |
| SCHEMBL20225448 | 0.71 | CAMK2D (0.41) | BACE1 | |
| SCHEMBL2027658 | 0.71 | BACE1 (0.42) | BACE1BACE2 | |
| SCHEMBL2025874 | 0.71 | BACE1 (0.42) | BACE1BACE2 | |
| SCHEMBL5649530 | 0.70 | BACE1 (0.47) | BACE1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7968571-B2 | 2,4,6-substituted pyridyl derivative compounds useful as beta-secretase inhibitors for the treatment of Alzheimer's Disease | Merck, Sharp & Dohme, Corp. (US) | 2011-06-28 | — | — | US | disclosed |