Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.49 |
| ▸ | BACE2 | Q9Y5Z0 | 12/20 | 0.48 |
| ▸ | APP | P05067 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CTSD | P07339 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7941398 | 0.84 | BACE1 (0.52) | BACE1BACE2APPCYP2D6CTSD | |
| SCHEMBL12445687 | 0.84 | KMT2A (0.46) | BACE1CYP2D6 | |
| SCHEMBL4078764 | 0.81 | BACE1 (0.64) | BACE1BACE2APPCYP2D6CTSD | |
| SCHEMBL4083855 | 0.81 | BACE1 (0.52) | BACE1BACE2APPCYP2D6CTSD | |
| SCHEMBL12445785 | 0.78 | BACE1 (0.51) | BACE1BACE2 | |
| SCHEMBL12445750 | 0.78 | BACE1 (0.53) | BACE1BACE2APPCYP2D6 | |
| SCHEMBL12446250 | 0.78 | BACE1 (0.48) | BACE1 | |
| SCHEMBL12445801 | 0.77 | NPC1 (0.44) | BACE1BACE2 | |
| SCHEMBL12446212 | 0.77 | BACE1 (0.51) | BACE1BACE2APPCTSD | |
| SCHEMBL7940367 | 0.76 | BACE1 (0.51) | 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 |
|---|---|---|---|---|---|---|---|
| EP-2360155-A1 | 2-AMINOPYRIDIN-4-ONE AND 2-AMINOPYRIDINE DERIVATIVE BOTH HAVING BACE1-INHIBITING ACTIVITY | Shionogi & Co., Ltd. (JP) | 2011-08-24 | — | — | EP | disclosed |