Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 6/20 | 0.39 |
| ▸ | BACE2 | Q9Y5Z0 | 3/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2023991 | 0.87 | BACE1 (0.41) | BACE1BACE2MAPK1 | |
| SCHEMBL4945797 | 0.82 | BACE1 (0.44) | BACE1BACE2 | |
| SCHEMBL4947313 | 0.78 | BACE1 (0.37) | BACE1BACE2MAPK1 | |
| SCHEMBL2027660 | 0.76 | BACE1 (0.36) | BACE1BACE2MAPK1 | |
| SCHEMBL12578541 | 0.76 | BACE1 (0.42) | BACE1BACE2 | |
| SCHEMBL4939179 | 0.72 | BACE1 (0.49) | BACE1BACE2 | |
| SCHEMBL4942412 | 0.72 | BACE1 (0.49) | BACE1BACE2 | |
| SCHEMBL2026306 | 0.71 | BACE1 (0.38) | BACE1BACE2MAPK1 | |
| SCHEMBL13269914 | 0.70 | BACE1 (0.40) | BACE1BACE2 | |
| SCHEMBL2023118 | 0.69 | 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 |
|---|---|---|---|---|---|---|---|
| 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 |