Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.81 |
| ▸ | KCNH2 | Q12809 | 15/20 | 0.73 |
| ▸ | BACE2 | Q9Y5Z0 | 5/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL9949326 | 0.90 | BACE1 (1.00) | BACE1KCNH2BACE2 | |
| SCHEMBL9948822 | 0.90 | BACE1 (1.00) | BACE1KCNH2BACE2 | |
| SCHEMBL10140387 | 0.87 | BACE1 (0.75) | BACE1KCNH2BACE2 | |
| SCHEMBL10140906 | 0.87 | BACE1 (0.70) | BACE1KCNH2BACE2 | |
| SCHEMBL10140391 | 0.85 | BACE1 (0.88) | BACE1KCNH2BACE2 | |
| SCHEMBL9949142 | 0.85 | BACE1 (1.00) | BACE1KCNH2BACE2 | |
| SCHEMBL9948853 | 0.84 | BACE1 (0.68) | BACE1KCNH2BACE2 | |
| SCHEMBL9949285 | 0.83 | BACE1 (0.73) | BACE1KCNH2BACE2 | |
| SCHEMBL9948901 | 0.83 | BACE1 (0.73) | BACE1KCNH2BACE2 | |
| SCHEMBL9949363 | 0.83 | BACE1 (1.00) | 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-2012087236-A1 | COMPOUNDS AND THEIR USE AS BACE INHIBITORS | ASTRAZENECA AB (SE) | 2012-06-28 | — | — | WO | disclosed |