Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.59 |
| ▸ | BACE2 | Q9Y5Z0 | 3/20 | 0.56 |
| ▸ | CTSD | P07339 | 3/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL3911412 | 0.93 | BACE1 (0.58) | BACE1BACE2CTSD | |
| SCHEMBL3914070 | 0.83 | BACE1 (0.59) | BACE1BACE2CTSD | |
| SCHEMBL3913101 | 0.82 | BACE1 (0.61) | BACE1BACE2CTSD | |
| SCHEMBL3903009 | 0.82 | BACE1 (0.61) | BACE1BACE2CTSD | |
| SCHEMBL3910738 | 0.82 | BACE1 (0.65) | BACE1BACE2CTSD | |
| SCHEMBL3915238 | 0.81 | BACE1 (0.59) | BACE1BACE2CTSD | |
| SCHEMBL3911532 | 0.80 | BACE1 (0.60) | BACE1BACE2CTSD | |
| SCHEMBL3352738 | 0.80 | BACE1 (0.85) | BACE1BACE2CTSD | |
| SCHEMBL13898694 | 0.80 | BACE1 (0.85) | BACE1BACE2CTSD | |
| SCHEMBL3914188 | 0.79 | BACE1 (0.59) | BACE1BACE2CTSD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7498436-B2 | Substituted hydroxyethylamines | PHARMACIA & UPJOHN COMPANY LLC (US) | 2009-03-03 | — | — | US | disclosed |
| US-7498436-B2 | Substituted hydroxyethylamines | PHARMACIA & UPJOHN COMPANY LLC (US) | 2009-03-03 | — | — | US | disclosed |