Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 16/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.40 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL966675 | 1.00 | BACE1 (0.49) | BACE1KCNH2BACE2CYP1A2MAPT | |
| SCHEMBL968571 | 0.89 | BACE1 (0.45) | BACE1KCNH2BACE2MAPTNPC1 | |
| SCHEMBL18192813 | 0.89 | BACE1 (0.45) | BACE1KCNH2BACE2MAPTNPC1 | |
| SCHEMBL18192807 | 0.88 | BACE1 (0.49) | BACE1KCNH2BACE2HDAC1 | |
| SCHEMBL18192914 | 0.84 | BACE1 (0.44) | BACE1KCNH2BACE2 | |
| SCHEMBL18192945 | 0.84 | BACE1 (0.44) | BACE1KCNH2BACE2 | |
| SCHEMBL969139 | 0.84 | BACE1 (0.53) | BACE1KCNH2BACE2 | |
| SCHEMBL18192820 | 0.84 | BACE1 (0.42) | BACE1KCNH2BACE2HDAC1 | |
| SCHEMBL14299099 | 0.84 | BACE1 (0.42) | BACE1KCNH2BACE2HDAC1 | |
| SCHEMBL16027252 | 0.83 | BACE1 (0.46) | BACE1KCNH2CYP1A2MAPTCYP2C9 |
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 |