Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.73 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.73 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.73 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.73 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.73 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.73 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.65 |
| ▸ | STAT6 | P42226 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.63 |
| ▸ | HPGD | P15428 | 3/20 | 0.63 |
| ▸ | FBP1 | P09467 | 2/20 | 0.63 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.63 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.63 |
| ▸ | DRD2 | P14416 | 1/20 | 0.63 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.63 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.63 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.63 |
| ▸ | DRD1 | P21728 | 1/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL9389929 | 0.86 | CYP1A2 (0.80) | CYP1A2CYP2D6CYP2C19CYP3A4L3MBTL1 | |
| SCHEMBL5837665 | 0.85 | CYP1A2 (1.00) | CYP1A2CYP2D6CYP2C19CYP3A4L3MBTL1 | |
| SCHEMBL9183570 | 0.81 | CYP1A2 (0.73) | CYP1A2CYP2D6CYP2C19CYP3A4L3MBTL1 | |
| SCHEMBL7155586 | 0.81 | CYP1A2 (0.73) | CYP1A2CYP2D6CYP2C19CYP3A4L3MBTL1 | |
| SCHEMBL21675444 | 0.81 | CYP1A2 (0.75) | CYP1A2CYP2D6CYP2C19CYP3A4L3MBTL1 | |
| SCHEMBL4758779 | 0.81 | CYP1A2 (0.73) | CYP1A2CYP2D6CYP2C19CYP3A4L3MBTL1 | |
| SCHEMBL774785 | 0.81 | CYP1A2 (0.73) | CYP1A2CYP2D6CYP2C19CYP3A4L3MBTL1 | |
| SCHEMBL8030894 | 0.81 | CYP1A2 (0.67) | CYP1A2CYP2D6CYP2C19CYP3A4L3MBTL1 | |
| SCHEMBL6141647 | 0.80 | CYP1A2 (0.83) | CYP1A2CYP2D6CYP2C19CYP3A4L3MBTL1 | |
| SCHEMBL745752 | 0.79 | CYP1A2 (0.80) | CYP1A2CYP2D6CYP2C19CYP3A4L3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117402091-A | Synthetic method of sodium monofluoromethylsulfinate | 瑞博(杭州)医药科技有限公司 | 2024-01-16 | — | — | CN | claimed |
| CN-117402091-A | Synthetic method of sodium monofluoromethylsulfinate | 瑞博(杭州)医药科技有限公司 | 2024-01-16 | — | — | CN | disclosed |