Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 20/20 | 0.54 |
| ▸ | BACE1 | P56817 | 20/20 | 0.54 |
| ▸ | BACE2 | Q9Y5Z0 | 20/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL5619490 | 1.00 | CTSD (0.54) | CTSDBACE1BACE2 | |
| SCHEMBL5619483 | 1.00 | CTSD (0.54) | CTSDBACE1BACE2 | |
| SCHEMBL5856491 | 0.93 | CTSD (0.61) | CTSDBACE1BACE2 | |
| SCHEMBL5856498 | 0.93 | CTSD (0.61) | CTSDBACE1BACE2 | |
| SCHEMBL5853084 | 0.89 | CTSD (0.66) | CTSDBACE1BACE2 | |
| SCHEMBL5853073 | 0.89 | CTSD (0.66) | CTSDBACE1BACE2 | |
| SCHEMBL5853570 | 0.88 | CTSD (0.57) | CTSDBACE1BACE2 | |
| SCHEMBL5855662 | 0.88 | CTSD (0.59) | CTSDBACE1BACE2 | |
| SCHEMBL5855656 | 0.88 | CTSD (0.59) | CTSDBACE1BACE2 | |
| SCHEMBL5853197 | 0.87 | CTSD (0.63) | CTSDBACE1BACE2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003045903-A1 | HYDROXYETHYLENE COMPOUNDS WITH ASP2 INHIBITORY ACTIVITY | SMITHKLINE BEECHAM P.L.C. (GB) | 2003-06-05 | — | — | WO | disclosed |