Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 13/20 | 0.42 |
| ▸ | CTSD | P07339 | 2/20 | 0.39 |
| ▸ | BACE2 | Q9Y5Z0 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.39 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 4/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL934242 | 0.89 | BACE1 (0.42) | BACE1CTSDBACE2KCNH2BCAT2 | |
| SCHEMBL18192849 | 0.85 | BACE1 (0.44) | BACE1CTSDBACE2KCNH2ABCB1 | |
| SCHEMBL18192805 | 0.85 | BACE1 (0.44) | BACE1CTSDBACE2KCNH2ABCB1 | |
| SCHEMBL18192860 | 0.85 | BACE1 (0.44) | BACE1CTSDBACE2KCNH2 | |
| SCHEMBL18192814 | 0.81 | BACE1 (0.44) | BACE1KCNH2BCAT2ABCB1ABL1 | |
| SCHEMBL6879675 | 0.79 | BACE1 (0.54) | BACE1CTSDBACE2KCNH2 | |
| Hydrochloric Acid SCHEMBL966118 | 0.78 | BACE1 (0.53) | BACE1CTSDBACE2KCNH2 | |
| SCHEMBL18192944 | 0.78 | BACE1 (0.42) | BACE1CTSDBACE2KCNH2BCAT2 | |
| SCHEMBL968793 | 0.77 | BACE1 (0.46) | BACE1CTSDBACE2KCNH2ABCB1 | |
| SCHEMBL18192895 | 0.77 | BACE1 (0.41) | BACE1BACE2KCNH2ABCB1ABL1 |
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 |