Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 1.00 |
| ▸ | BACE2 | Q9Y5Z0 | 13/20 | 1.00 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.69 |
| ▸ | CTSD | P07339 | 1/20 | 0.69 |
| ▸ | CYP2D6 | P10635 | 2/20 | 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 | |
|---|---|---|---|---|
| Ly-2886721 SCHEMBL971344 | 1.00 | BACE1 (1.00) | BACE1BACE2KCNH2CTSDCYP2D6 | |
| Ly-2886721 SCHEMBL966802 | 1.00 | BACE1 (1.00) | BACE1BACE2KCNH2CTSDCYP2D6 | |
| Ly-2886721 SCHEMBL30477100 | 1.00 | BACE1 (1.00) | BACE1BACE2KCNH2CTSDCYP2D6 | |
| Ly-2886721 SCHEMBL970474 | 0.99 | BACE1 (0.98) | BACE1BACE2KCNH2CTSDCYP2D6 | |
| Ly-2886721 SCHEMBL31235710 | 0.99 | BACE1 (0.98) | BACE1BACE2KCNH2CTSDCYP2D6 | |
| SCHEMBL2620122 | 0.93 | BACE1 (0.87) | BACE1BACE2KCNH2CTSDCYP2D6 | |
| SCHEMBL2932592 | 0.93 | BACE1 (0.87) | BACE1BACE2KCNH2CTSDCYP2D6 | |
| SCHEMBL3306806 | 0.91 | BACE1 (0.84) | BACE1BACE2KCNH2CTSDCYP2D6 | |
| SCHEMBL2620249 | 0.91 | BACE1 (0.84) | BACE1BACE2KCNH2CTSDCYP2D6 | |
| SCHEMBL2965834 | 0.91 | BACE1 (0.84) | BACE1BACE2KCNH2CTSDCYP2D6 |
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 |