Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 2/20 | 0.54 |
| ▸ | KIF11 | P52732 | 2/20 | 0.53 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.47 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.47 |
| ▸ | ALOX5AP | P20292 | 6/20 | 0.46 |
| ▸ | FEN1 | P39748 | 6/20 | 0.46 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.42 |
| ▸ | MPL | P40238 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17508160 | 0.87 | KIF11 (0.53) | APPKIF11AKR1C3AKR1C2ALOX5AP | |
| SCHEMBL24408851 | 0.84 | RORC (0.55) | RORC | |
| SCHEMBL29511314 | 0.84 | RORC (0.55) | RORC | |
| SCHEMBL4411615 | 0.83 | AKR1C3 (0.57) | APPKIF11AKR1C3AKR1C2ALOX5AP | |
| SCHEMBL31227778 | 0.83 | AKR1C3 (0.47) | APPKIF11AKR1C3AKR1C2ALOX5AP | |
| SCHEMBL23226467 | 0.82 | GRM2 (0.44) | APPKIF11AKR1C3AKR1C2ALOX5AP | |
| SCHEMBL18001814 | 0.80 | KIF11 (0.57) | KIF11AKR1C3AKR1C2PTGS1 | |
| SCHEMBL30679636 | 0.80 | AKR1C3 (0.53) | KIF11AKR1C3AKR1C2ALOX5APFEN1 | |
| SCHEMBL416643 | 0.79 | PTGS1 (0.51) | KIF11GRM2PTGS1 | |
| SCHEMBL31120808 | 0.79 | PTGS1 (0.51) | KIF11GRM2PTGS1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016019588-A1 | OXACAZONE COMPOUNDS TO TREAT CLOSTRIDIUM DIFFICILE | THE BROAD INSTITUTE, INC. (US) | 2016-02-11 | — | — | WO | disclosed |
| WO-2016019588-A1 | OXACAZONE COMPOUNDS TO TREAT CLOSTRIDIUM DIFFICILE | THE BROAD INSTITUTE, INC. (US) | 2016-02-11 | — | — | WO | disclosed |
| EP-1479671-B1 | Pyrimidinone compounds | SMITHKLINE BEECHAM PLC (GB) | 2009-05-27 | — | — | EP | disclosed |
| US-7115616-B2 | Pyrimidinone compounds | SMITHKLINE BEECHAM PLC (GB) | 2006-10-03 | — | — | US | disclosed |