Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 11/20 | 0.33 |
| ▸ | CTSB | P07858 | 2/20 | 0.33 |
| ▸ | CTSD | P07339 | 5/20 | 0.32 |
| ▸ | APP | P05067 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12246822 | 0.91 | BACE1 (0.34) | BACE1CTSBCTSDAPP | |
| SCHEMBL7959189 | 0.91 | BACE1 (0.35) | BACE1CTSB | |
| SCHEMBL7958145 | 0.89 | BACE1 (0.39) | BACE1CTSD | |
| SCHEMBL7958612 | 0.88 | BACE1 (0.33) | BACE1CTSB | |
| SCHEMBL7961899 | 0.88 | BACE1 (0.33) | BACE1CTSB | |
| SCHEMBL7947158 | 0.88 | BACE1 (0.33) | BACE1CTSB | |
| SCHEMBL7970112 | 0.88 | BACE1 (0.33) | BACE1CTSB | |
| SCHEMBL7958640 | 0.88 | BACE1 (0.37) | BACE1CTSBCTSDAPP | |
| SCHEMBL7973266 | 0.88 | BACE1 (0.37) | BACE1CTSBCTSDAPP | |
| SCHEMBL7954460 | 0.88 | BACE1 (0.33) | BACE1CTSBCTSD |
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-2010021680-A2 | INHIBITORS OF BETA-SECRETASE | VITAE PHARMACEUTICALS, INC. (US) | 2010-02-25 | — | — | WO | disclosed |