Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | GRM8 | O00222 | 1/20 | 0.43 |
| ▸ | GRM6 | O15303 | 1/20 | 0.43 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL19728209 | 0.83 | CA1 (0.58) | AOC3CYP2D6CYP1A2CYP2C19CA12 | |
| SCHEMBL11938484 | 0.83 | CA1 (0.58) | AOC3CYP2D6CYP1A2CYP2C19CA12 | |
| SCHEMBL11938486 | 0.83 | CA1 (0.58) | AOC3CYP2D6CYP1A2CYP2C19CA12 | |
| SCHEMBL3695690 | 0.83 | CA1 (0.58) | AOC3CYP2D6CYP1A2CYP2C19CA12 | |
| SCHEMBL19728201 | 0.83 | CA1 (0.58) | AOC3CYP2D6CYP1A2CYP2C19CA12 | |
| SCHEMBL30620666 | 0.82 | AOC3 (0.50) | AOC3CYP2D6CYP1A2CYP2C19CA12 | |
| SCHEMBL11419589 | 0.82 | KDM4E (0.57) | AOC3CYP2D6CYP1A2CYP2C19MAPK1 | |
| SCHEMBL25554 | 0.82 | AOC3 (0.50) | AOC3CYP2D6CYP1A2CYP2C19CA12 | |
| SCHEMBL5484871 | 0.82 | KDM4E (0.57) | AOC3CYP2D6CYP1A2CYP2C19MAPK1 | |
| SCHEMBL18082658 | 0.82 | KDM4E (0.57) | AOC3CYP2D6CYP1A2CYP2C19MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6156940-A | Process for producing optically active carbinols | SUMIKA FINE CHEMICALS COMPANY, LIMITED (JP) | 2000-12-05 | — | — | US | disclosed |