Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 13/20 | 0.50 |
| ▸ | BACE2 | Q9Y5Z0 | 6/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6886289 | 0.84 | MAOB (0.38) | BACE1KCNH2 | |
| SCHEMBL930782 | 0.77 | BACE1 (0.50) | BACE1KCNH2BACE2 | |
| SCHEMBL931345 | 0.77 | BACE1 (0.67) | BACE1KCNH2BACE2 | |
| SCHEMBL931386 | 0.77 | BACE1 (0.67) | BACE1KCNH2BACE2 | |
| SCHEMBL930937 | 0.77 | BACE1 (0.67) | BACE1KCNH2BACE2 | |
| SCHEMBL931362 | 0.76 | BACE1 (0.61) | BACE1KCNH2BACE2 | |
| SCHEMBL29767725 | 0.76 | BACE1 (0.61) | BACE1KCNH2BACE2 | |
| SCHEMBL3357623 | 0.74 | BACE1 (0.59) | BACE1KCNH2BACE2 | |
| SCHEMBL3357398 | 0.74 | BACE1 (0.58) | BACE1KCNH2BACE2 | |
| SCHEMBL6884548 | 0.73 | BACE1 (0.54) | BACE1KCNH2BACE2 |
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-2011002409-A1 | 5H-PYRROLO[3,4-£>]PYRAZIN-7-AMINE DERIVATIVES INHIBITORS OF BETA-SECRETASE | ASTRAZENECA AB (SE) | 2011-01-06 | — | — | WO | disclosed |