Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.51 |
| ▸ | BACE2 | Q9Y5Z0 | 9/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.50 |
| ▸ | CTSD | P07339 | 5/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2084313 | 0.87 | BACE1 (0.63) | BACE1BACE2KCNH2CTSD | |
| SCHEMBL2086154 | 0.78 | BACE1 (0.76) | BACE1BACE2KCNH2CTSD | |
| SCHEMBL2085910 | 0.78 | BACE1 (0.62) | BACE1BACE2KCNH2CTSD | |
| SCHEMBL2083978 | 0.75 | BACE1 (0.59) | BACE1BACE2KCNH2CTSD | |
| SCHEMBL3550208 | 0.73 | BACE1 (0.83) | BACE1BACE2KCNH2CTSD | |
| SCHEMBL2085144 | 0.72 | BACE1 (0.59) | BACE1BACE2KCNH2CTSD | |
| SCHEMBL2084817 | 0.68 | BACE1 (0.50) | BACE1BACE2KCNH2CTSD | |
| SCHEMBL2085890 | 0.68 | BACE1 (0.74) | BACE1BACE2KCNH2CTSD | |
| SCHEMBL2085037 | 0.68 | BACE1 (0.62) | BACE1BACE2KCNH2CTSD | |
| Trifluoroacetic Acid SCHEMBL2087051 | 0.68 | BACE1 (0.68) | BACE1BACE2KCNH2CTSD |
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-2007149033-A1 | SUBSTITUTED ISOINDOLES AS BACE INHIBITORS AND THEIR USE | ASTRAZENECA AB (SE) | 2007-12-27 | — | — | WO | disclosed |