Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.38 |
| ▸ | CDC42BPB | Q9Y5S2 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | IGF1R | P08069 | 1/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
| ▸ | PIM1 | P11309 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | BRD4 | O60885 | 3/20 | 0.34 |
| ▸ | ATAD2 | Q6PL18 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27171097 | 0.81 | MAPK1 (0.44) | HDAC1MAPK1HRH4 | |
| SCHEMBL617303 | 0.77 | HRH3 (0.42) | HRH3HDAC1ROCK2ROCK1CDC42BPB | |
| SCHEMBL8244028 | 0.74 | HRH3 (0.36) | HRH3HDAC1ROCK2MAPK1IGF1R | |
| SCHEMBL13808614 | 0.73 | HRH3 (0.41) | HRH3HDAC1ROCK2ROCK1CDC42BPB | |
| SCHEMBL13742816 | 0.73 | AOC1 (0.48) | HRH3HDAC1ROCK2ROCK1CDC42BPB | |
| SCHEMBL15740694 | 0.70 | MEN1 (0.40) | MAPK1MEN1CYP2D6KMT2ACYP2C19 | |
| SCHEMBL22725031 | 0.70 | IKBKB (0.42) | HRH3BRD4ATAD2CYP3A4ALDH1A1 | |
| SCHEMBL14046305 | 0.70 | ROCK2 (0.50) | HRH3ROCK2ROCK1CDC42BPBCYP1A2 | |
| Hydrochloric Acid SCHEMBL23360049 | 0.69 | MAPK1 (0.47) | HRH3ROCK2ROCK1CDC42BPBMAPK1 | |
| Hydrochloric Acid SCHEMBL29862503 | 0.69 | MAPK1 (0.47) | HRH3ROCK2ROCK1CDC42BPBMAPK1 |
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-2012086735-A1 | CONDENSED HETEROCYCLIC COMPOUND | 大正製薬株式会社 (JP) | 2012-06-28 | — | — | WO | disclosed |