Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.36 |
| ▸ | CTSD | P07339 | 8/20 | 0.34 |
| ▸ | BACE2 | Q9Y5Z0 | 8/20 | 0.34 |
| ▸ | REN | P00797 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL932068 | 1.00 | BACE1 (0.36) | BACE1CTSDBACE2RENKCNH2 | |
| Hydrochloric Acid SCHEMBL934082 | 0.99 | BACE1 (0.36) | BACE1CTSDBACE2RENKCNH2 | |
| SCHEMBL932396 | 0.82 | BACE1 (0.47) | BACE1CTSDBACE2KCNH2 | |
| SCHEMBL933494 | 0.82 | BACE1 (0.47) | BACE1CTSDBACE2KCNH2 | |
| SCHEMBL3700140 | 0.82 | ABL1 (0.33) | BACE1CTSDBACE2REN | |
| SCHEMBL933095 | 0.77 | BACE1 (0.35) | BACE1CTSDBACE2REN | |
| Hydrochloric Acid SCHEMBL933053 | 0.76 | BACE1 (0.45) | BACE1CTSDBACE2 | |
| SCHEMBL967378 | 0.76 | BACE1 (0.55) | BACE1BACE2 | |
| SCHEMBL6877960 | 0.76 | BACE1 (0.55) | BACE1BACE2 | |
| SCHEMBL932785 | 0.76 | BACE1 (0.55) | BACE1BACE2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2451793-A1 | BACE INHIBITORS | Eli Lilly and Company (US) | 2012-05-16 | — | — | EP | disclosed |
| WO-2011005738-A1 | BACE INHIBITORS | ELI LILLY AND COMPANY (US) | 2011-01-13 | — | — | WO | disclosed |