Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 18/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2026059 | 0.79 | BACE1 (0.50) | BACE1 | |
| SCHEMBL12578838 | 0.65 | BACE1 (0.56) | BACE1 | |
| SCHEMBL12578623 | 0.65 | BACE1 (0.50) | BACE1 | |
| SCHEMBL831403 | 0.64 | BACE1 (0.63) | BACE1 | |
| SCHEMBL831402 | 0.64 | BACE1 (0.63) | BACE1 | |
| SCHEMBL2028914 | 0.64 | BACE1 (0.56) | BACE1 | |
| SCHEMBL2255225 | 0.64 | BACE1 (0.56) | BACE1 | |
| SCHEMBL831254 | 0.63 | BACE1 (0.50) | BACE1 | |
| SCHEMBL4078824 | 0.63 | BACE1 (0.50) | BACE1 | |
| SCHEMBL2018884 | 0.62 | BACE1 (0.46) | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1740581-A4 | 2, 4, 6-SUBSTITUTED PYRIDYL DERIVATIVE COMPOUNDS USEFUL AS BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | MERCK & CO INC (US) | 2008-01-23 | — | — | EP | disclosed |
| EP-1740581-A1 | 2, 4, 6-SUBSTITUTED PYRIDYL DERIVATIVE COMPOUNDS USEFUL AS BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER\"S DISEASE | Merck and Co., Inc. (US) | 2007-01-10 | — | — | EP | disclosed |
| WO-2005103043-A1 | 2, 4, 6-SUBSTITUTED PYRIDYL DERIVATIVE COMPOUNDS USEFUL AS BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER’S DISEASE | MERCK & CO., INC. (US) | 2005-11-03 | — | — | WO | disclosed |