Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 14/20 | 0.45 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3479588 | 0.91 | BACE1 (0.55) | BACE1 | |
| SCHEMBL4257463 | 0.91 | BACE1 (0.55) | BACE1 | |
| SCHEMBL3479536 | 0.90 | BACE1 (0.44) | BACE1 | |
| Trifluoroacetic Acid SCHEMBL3479642 | 0.87 | BACE1 (0.51) | BACE1 | |
| SCHEMBL3479586 | 0.83 | BACE1 (0.57) | BACE1 | |
| SCHEMBL8203688 | 0.82 | BACE1 (0.42) | BACE1HCRTR1HCRTR2 | |
| SCHEMBL3479379 | 0.81 | BACE1 (0.59) | BACE1 | |
| SCHEMBL3479552 | 0.80 | BACE1 (0.57) | BACE1 | |
| SCHEMBL3479484 | 0.78 | BACE1 (0.56) | BACE1 | |
| SCHEMBL3479637 | 0.78 | BACE1 (0.48) | 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 |
|---|---|---|---|---|---|---|---|
| WO-2008030412-A2 | SPIROPIPERIDINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | MERCK & CO., INC. (US) | 2008-03-13 | — | — | WO | disclosed |