Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.31 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | TDO2 | P48775 | 1/20 | 0.30 |
| ▸ | IDO2 | Q6ZQW0 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31428693 | 0.94 | ALDH1A1 (0.33) | ALDH1A1MAPTMAPK1HTTSMN1; SMN2 | |
| SCHEMBL31428785 | 0.91 | PDE9A (0.34) | ALDH1A1MAPTMAPK1HTTSMN1; SMN2 | |
| SCHEMBL31428765 | 0.90 | ALDH1A1 (0.32) | ALDH1A1MAPTMAPK1HTTSMN1; SMN2 | |
| SCHEMBL31428533 | 0.89 | CREBBP (0.33) | MAPK1 | |
| SCHEMBL24976105 | 0.89 | CREBBP (0.33) | MAPK1 | |
| SCHEMBL31428691 | 0.87 | UCHL1 (0.35) | HSD11B1 | |
| SCHEMBL24975829 | 0.87 | MAPK1 (0.32) | MAPK1HSD11B1NR1H4 | |
| SCHEMBL31428620 | 0.87 | MAPK1 (0.32) | MAPK1HSD11B1NR1H4 | |
| SCHEMBL24975810 | 0.85 | GRM2 (0.35) | MAPTHSD11B1NR1H4EZH2 | |
| SCHEMBL31428558 | 0.85 | GRM2 (0.35) | MAPTHSD11B1NR1H4EZH2 |
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-2023008577-A1 | RAS/RAF BINDING INHIBITOR COMPOUND | 国立大学法人神戸大学 | 2023-02-02 | — | — | WO | disclosed |