Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 8/20 | 0.55 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.55 |
| ▸ | AKR1A1 | P14550 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7956191 | 0.89 | AKR1B1 (0.47) | AKR1B1AKR1B10AKR1A1MAPT | |
| SCHEMBL1823189 | 0.87 | AKR1B1 (0.55) | AKR1B1AKR1B10AKR1A1MAPTMAOB | |
| SCHEMBL7957860 | 0.83 | AKR1B1 (0.48) | AKR1B1AKR1B10AKR1A1MAPT | |
| SCHEMBL7956715 | 0.79 | AKR1B1 (0.41) | AKR1B1AKR1B10AKR1A1MAPT | |
| SCHEMBL7948437 | 0.79 | AKR1B1 (0.41) | AKR1B1AKR1B10AKR1A1MAOB | |
| SCHEMBL7949174 | 0.78 | AKR1B1 (0.35) | AKR1B1AKR1B10AKR1A1 | |
| SCHEMBL7957182 | 0.78 | ALOX12 (0.39) | AKR1B1AKR1B10AKR1A1MAPTMAOB | |
| SCHEMBL1824168 | 0.76 | AKR1B1 (0.43) | AKR1B1AKR1B10AKR1A1MAPTMAOB | |
| SCHEMBL1822427 | 0.76 | AKR1B1 (0.45) | AKR1B1AKR1B10AKR1A1MAPT | |
| SCHEMBL1825156 | 0.75 | AKR1B1 (0.53) | AKR1B1AKR1B10AKR1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010021680-A2 | INHIBITORS OF BETA-SECRETASE | VITAE PHARMACEUTICALS, INC. (US) | 2010-02-25 | — | — | WO | disclosed |