Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.50 |
| ▸ | CTSD | P07339 | 9/20 | 0.42 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13238194 | 1.00 | BACE1 (0.50) | BACE1CTSDBACE2 | |
| SCHEMBL4549163 | 0.83 | BACE1 (0.53) | BACE1CTSD | |
| SCHEMBL4549145 | 0.77 | BACE1 (0.64) | BACE1CTSD | |
| SCHEMBL13238190 | 0.77 | BACE1 (0.31) | BACE1 | |
| SCHEMBL13054040 | 0.77 | BACE1 (0.45) | BACE1CTSD | |
| SCHEMBL4549205 | 0.76 | BACE1 (0.53) | BACE1CTSD | |
| SCHEMBL7568259 | 0.76 | BACE1 (0.44) | BACE1CTSD | |
| SCHEMBL10329029 | 0.74 | BACE1 (0.51) | BACE1CTSDBACE2 | |
| SCHEMBL15292010 | 0.74 | BACE1 (0.52) | BACE1CTSD | |
| SCHEMBL4549166 | 0.74 | BACE1 (0.52) | BACE1CTSD |
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-1891021-B1 | ASPARTYL PROTEASE INHIBITORS | MERCK SHARP & DOHME (US) | 2019-01-23 | — | — | EP | disclosed |