Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.45 |
| ▸ | BACE2 | Q9Y5Z0 | 7/20 | 0.45 |
| ▸ | CTSD | P07339 | 6/20 | 0.45 |
| ▸ | REN | P00797 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 7/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3357418 | 0.90 | BACE1 (0.46) | BACE1BACE2CTSDRENKCNH2 | |
| SCHEMBL931387 | 0.82 | BACE1 (0.52) | BACE1BACE2KCNH2 | |
| SCHEMBL931363 | 0.82 | BACE1 (0.52) | BACE1BACE2CTSDRENKCNH2 | |
| SCHEMBL931347 | 0.82 | BACE1 (0.52) | BACE1BACE2KCNH2 | |
| SCHEMBL930938 | 0.82 | BACE1 (0.52) | BACE1BACE2KCNH2 | |
| SCHEMBL3358063 | 0.79 | BACE1 (0.39) | BACE1BACE2CTSDKCNH2 | |
| SCHEMBL931248 | 0.79 | BACE1 (0.53) | BACE1BACE2CTSDRENKCNH2 | |
| SCHEMBL930784 | 0.77 | BACE1 (0.43) | BACE1BACE2CTSDRENKCNH2 | |
| SCHEMBL3356554 | 0.76 | BACE1 (0.45) | BACE1BACE2CTSDRENKCNH2 | |
| SCHEMBL3356799 | 0.75 | CTSD (0.37) | BACE1BACE2CTSD |
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 |