Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 8/20 | 0.34 |
| ▸ | CTSD | P07339 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17715585 | 0.90 | BACE1 (0.35) | BACE1CTSDMMP1MMP3MMP9 | |
| SCHEMBL10305496 | 0.90 | BACE1 (0.35) | BACE1CTSDMMP1MMP3MMP9 | |
| SCHEMBL8288261 | 0.89 | BACE1 (0.34) | BACE1CTSDMMP1MMP3MMP9 | |
| SCHEMBL7511536 | 0.85 | BACE1 (0.41) | BACE1CTSD | |
| SCHEMBL7508906 | 0.85 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL7518379 | 0.85 | BACE1 (0.38) | BACE1CTSD | |
| SCHEMBL7517307 | 0.84 | BACE1 (0.41) | BACE1CTSD | |
| SCHEMBL7520462 | 0.83 | BACE1 (0.37) | BACE1CTSD | |
| SCHEMBL7519186 | 0.83 | BACE1 (0.45) | BACE1CTSD | |
| SCHEMBL7523751 | 0.82 | EPHX1 (0.43) | BACE1 |
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-2005058311-A1 | HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS | SCHERING CORPORATION (US) | 2005-06-30 | — | — | WO | disclosed |