Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 19/20 | 0.46 |
| ▸ | BACE2 | Q9Y5Z0 | 4/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.39 |
| ▸ | CTSD | P07339 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL967092 | 0.89 | BACE1 (0.49) | BACE1BACE2KCNH2CTSD | |
| SCHEMBL967582 | 0.89 | BACE1 (0.49) | BACE1BACE2KCNH2CTSD | |
| SCHEMBL6877012 | 0.89 | BACE1 (0.49) | BACE1BACE2KCNH2CTSD | |
| SCHEMBL18192897 | 0.87 | BACE1 (0.44) | BACE1BACE2KCNH2CTSDNPC1 | |
| SCHEMBL2926816 | 0.87 | BACE1 (0.47) | BACE1BACE2KCNH2 | |
| SCHEMBL2619830 | 0.87 | BACE1 (0.47) | BACE1BACE2KCNH2 | |
| SCHEMBL969139 | 0.85 | BACE1 (0.53) | BACE1BACE2KCNH2CTSD | |
| SCHEMBL17296553 | 0.85 | BACE1 (0.51) | BACE1BACE2KCNH2CTSD | |
| SCHEMBL15783586 | 0.85 | BACE1 (0.51) | BACE1BACE2KCNH2CTSD | |
| SCHEMBL15783584 | 0.85 | BACE1 (0.50) | 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 |
|---|---|---|---|---|---|---|---|
| EP-2451793-B1 | BACE INHIBITORS | LILLY CO ELI (US) | 2016-11-02 | — | — | EP | disclosed |