Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 19/20 | 0.36 |
| ▸ | REN | P00797 | 7/20 | 0.36 |
| ▸ | CTSD | P07339 | 7/20 | 0.36 |
| ▸ | BACE2 | Q9Y5Z0 | 7/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TDP2 | O95551 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8206032 | 0.89 | BACE1 (0.40) | BACE1RENCTSDBACE2CYP3A4 | |
| SCHEMBL7570760 | 0.89 | BACE1 (0.40) | BACE1RENCTSDBACE2CYP3A4 | |
| SCHEMBL13054494 | 0.89 | BACE1 (0.40) | BACE1RENCTSDBACE2CYP3A4 | |
| SCHEMBL7584411 | 0.89 | KMT2A (0.32) | BACE1CYP3A4 | |
| SCHEMBL7582435 | 0.88 | BACE1 (0.34) | BACE1BACE2 | |
| SCHEMBL7589796 | 0.87 | ALDH1A1 (0.32) | BACE1 | |
| SCHEMBL7584363 | 0.84 | BACE1 (0.36) | BACE1RENCTSDBACE2 | |
| SCHEMBL7584231 | 0.84 | ELANE (0.33) | BACE1CYP3A4 | |
| SCHEMBL7581190 | 0.83 | BACE1 (0.31) | BACE1 | |
| SCHEMBL7584371 | 0.82 | BACE1 (0.31) | 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 |
|---|---|---|---|---|---|---|---|
| US-8183252-B2 | Heterocyclic aspartyl protease inhibitors | SCHERING CORPORATION (US) | 2012-05-22 | — | — | US | disclosed |