Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 18/20 | 0.57 |
| ▸ | CTSD | P07339 | 17/20 | 0.57 |
| ▸ | APP | P05067 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7957739 | 1.00 | BACE1 (0.57) | BACE1CTSDAPP | |
| SCHEMBL12245167 | 1.00 | BACE1 (0.57) | BACE1CTSDAPP | |
| SCHEMBL7955992 | 1.00 | BACE1 (0.57) | BACE1CTSDAPP | |
| SCHEMBL7947760 | 0.91 | BACE1 (0.58) | BACE1CTSDAPP | |
| SCHEMBL7956734 | 0.91 | BACE1 (0.58) | BACE1CTSDAPP | |
| SCHEMBL12246917 | 0.91 | BACE1 (0.58) | BACE1CTSDAPP | |
| SCHEMBL7949036 | 0.90 | BACE1 (0.67) | BACE1CTSD | |
| SCHEMBL7965156 | 0.90 | BACE1 (0.67) | BACE1CTSD | |
| SCHEMBL7950555 | 0.90 | BACE1 (0.67) | BACE1CTSD | |
| SCHEMBL7959054 | 0.90 | BACE1 (0.70) | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8921359-B2 | Inhibitors of beta-secretase | VITAE PHARMACEUTICALS, INC. (US) | 2014-12-30 | — | — | US | disclosed |
| US-8921359-B2 | Inhibitors of beta-secretase | VITAE PHARMACEUTICALS, INC. (US) | 2014-12-30 | — | — | US | disclosed |
| WO-2010021680-A2 | INHIBITORS OF BETA-SECRETASE | VITAE PHARMACEUTICALS, INC. (US) | 2010-02-25 | — | — | WO | disclosed |