Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.58 |
| ▸ | BACE2 | Q9Y5Z0 | 10/20 | 0.58 |
| ▸ | CTSD | P07339 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL932395 | 0.92 | BACE1 (0.55) | BACE1BACE2CTSD | |
| SCHEMBL933007 | 0.88 | BACE1 (0.53) | BACE1BACE2CTSD | |
| SCHEMBL932340 | 0.88 | BACE1 (0.67) | BACE1BACE2CTSD | |
| SCHEMBL934283 | 0.88 | BACE1 (0.67) | BACE1BACE2CTSD | |
| Hydrochloric Acid SCHEMBL932077 | 0.87 | BACE1 (0.66) | BACE1BACE2CTSD | |
| SCHEMBL14059435 | 0.82 | BACE1 (0.58) | BACE1BACE2CTSD | |
| SCHEMBL12694642 | 0.80 | BACE1 (0.80) | BACE1BACE2CTSD | |
| SCHEMBL933409 | 0.80 | BACE1 (0.80) | BACE1BACE2CTSD | |
| SCHEMBL932343 | 0.78 | BACE1 (0.37) | BACE1BACE2 | |
| SCHEMBL932814 | 0.78 | BACE1 (0.46) | 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-2451793-A1 | BACE INHIBITORS | Eli Lilly and Company (US) | 2012-05-16 | — | — | EP | disclosed |