Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | MAOB | P27338 | 2/20 | 0.50 |
| ▸ | CHAT | P28329 | 2/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | TNKS | O95271 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3259240 | 1.00 | CYP2C19 (0.55) | CYP2C19MAOBCHATEGFRALDH1A1 | |
| SCHEMBL6286942 | 1.00 | CYP2C19 (0.55) | CYP2C19MAOBCHATEGFRALDH1A1 | |
| SCHEMBL26917 | 1.00 | CYP2C19 (0.55) | CYP2C19MAOBCHATEGFRALDH1A1 | |
| SCHEMBL29171014 | 0.97 | CYP2C19 (0.53) | CYP2C19MAOBCHATEGFRALDH1A1 | |
| Water SCHEMBL15415928 | 0.97 | CYP2C19 (0.53) | CYP2C19MAOBCHATEGFRALDH1A1 | |
| Ethylene SCHEMBL17997367 | 0.95 | CYP2C19 (0.52) | CYP2C19MAOBCHATEGFRALDH1A1 | |
| Butadiene SCHEMBL7155720 | 0.93 | CYP2C19 (0.50) | CYP2C19MAOBCHATEGFRALDH1A1 | |
| SCHEMBL3713678 | 0.91 | CYP2C19 (0.48) | CYP2C19MAOBCHATEGFRALDH1A1 | |
| O-Xylene SCHEMBL10337916 | 0.91 | CYP2C19 (0.48) | CYP2C19MAOBCHATEGFRALDH1A1 | |
| Styrene SCHEMBL3804814 | 0.91 | ALDH1A1 (0.61) | CYP2C19MAOBCHATEGFRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115484845-A | Self-disinfecting mask | 科腾聚合物有限责任公司 | 2022-12-16 | — | — | CN | disclosed |