Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 15/20 | 0.52 |
| ▸ | CTSD | P07339 | 13/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7546329 | 0.93 | BACE1 (0.54) | BACE1CTSDALDH1A1NPC1RAB9A | |
| SCHEMBL7541337 | 0.90 | BACE1 (0.54) | BACE1CTSD | |
| SCHEMBL13441092 | 0.90 | BACE1 (0.58) | BACE1CTSDALDH1A1TSHRNPC1 | |
| SCHEMBL7544493 | 0.89 | BACE1 (0.64) | BACE1CTSDHPGD | |
| SCHEMBL7538134 | 0.88 | BACE1 (0.59) | BACE1CTSDALDH1A1TSHRNPC1 | |
| SCHEMBL7540133 | 0.88 | BACE1 (0.66) | BACE1CTSD | |
| SCHEMBL7538499 | 0.87 | BACE1 (0.55) | BACE1CTSDALDH1A1TSHRNPC1 | |
| SCHEMBL12191149 | 0.87 | BACE1 (0.55) | BACE1CTSDALDH1A1TSHRNPC1 | |
| SCHEMBL7539480 | 0.87 | BACE1 (0.53) | BACE1CTSDALDH1A1TSHR | |
| SCHEMBL7540707 | 0.86 | BACE1 (0.53) | BACE1CTSDALDH1A1TSHRNPC1 |
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-7700603-B2 | Heterocyclic aspartyl protease inhibitors | SCHERING CORPORATION (US) | 2010-04-20 | — | — | US | disclosed |