Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.64 |
| ▸ | CTSD | P07339 | 10/20 | 0.64 |
| ▸ | APP | P05067 | 1/20 | 0.51 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7958374 | 1.00 | BACE1 (0.64) | BACE1CTSDAPPBACE2 | |
| SCHEMBL7950269 | 1.00 | BACE1 (0.64) | BACE1CTSDAPPBACE2 | |
| SCHEMBL12245332 | 1.00 | BACE1 (0.64) | BACE1CTSDAPPBACE2 | |
| SCHEMBL7969279 | 0.94 | BACE1 (0.55) | BACE1CTSDAPP | |
| SCHEMBL7959124 | 0.91 | BACE1 (0.53) | BACE1CTSDAPP | |
| SCHEMBL12246882 | 0.91 | BACE1 (0.52) | BACE1CTSDAPP | |
| SCHEMBL7959802 | 0.90 | BACE1 (0.51) | BACE1CTSDAPP | |
| SCHEMBL7961560 | 0.89 | BACE1 (0.50) | BACE1CTSDAPP | |
| SCHEMBL12246875 | 0.89 | BACE1 (0.55) | BACE1CTSDAPP | |
| SCHEMBL7955500 | 0.89 | BACE1 (0.64) | BACE1CTSDAPP |
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 |