Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.49 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.41 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5807549 | 0.93 | TLR8 (0.54) | ALDH1A1POLBKMT2ATLR8AGTR1 | |
| SCHEMBL9935809 | 0.89 | ALDH1A1 (0.63) | ALDH1A1POLBKMT2ATLR8AGTR1 | |
| SCHEMBL1049122 | 0.87 | ALDH1A1 (0.61) | ALDH1A1POLBKMT2ATLR8AGTR1 | |
| SCHEMBL4361611 | 0.87 | ALDH1A1 (0.61) | ALDH1A1POLBKMT2ATLR8AGTR1 | |
| SCHEMBL6115033 | 0.87 | ALDH1A1 (0.61) | ALDH1A1POLBKMT2ATLR8AGTR1 | |
| SCHEMBL31590567 | 0.86 | ALDH1A1 (0.47) | ALDH1A1POLBKMT2ATLR8AGTR1 | |
| Bromide SCHEMBL4479559 | 0.86 | ALDH1A1 (0.59) | ALDH1A1POLBKMT2ATLR8AGTR1 | |
| SCHEMBL2397143 | 0.86 | ALDH1A1 (0.59) | ALDH1A1POLBKMT2ATLR8AGTR1 | |
| SCHEMBL5655366 | 0.86 | ALDH1A1 (0.59) | ALDH1A1POLBKMT2ATLR8AGTR1 | |
| Water SCHEMBL28178859 | 0.86 | ALDH1A1 (0.59) | ALDH1A1POLBKMT2ATLR8AGTR1 |
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-2711368-B1 | Benzoxazepin PI3K inhibitor compounds and methods of use | HOFFMANN LA ROCHE (CH) | 2016-03-23 | — | — | EP | disclosed |