Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.69 |
| ▸ | CYP1A1 | P04798 | 6/20 | 0.50 |
| ▸ | CYP1B1 | Q16678 | 6/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.44 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP4B1 | P13584 | 2/20 | 0.44 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.44 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.44 |
| ▸ | CYP2A7 | P20853 | 2/20 | 0.44 |
| ▸ | CYP3A7 | P24462 | 2/20 | 0.44 |
| ▸ | CYP2F1 | P24903 | 2/20 | 0.44 |
| ▸ | CYP2C18 | P33260 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP2J2 | P51589 | 2/20 | 0.44 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2636216 | 0.86 | ALDH1A1 (0.58) | ALDH1A1CYP1A1CYP1B1CYP3A4CYP1A2 | |
| 1,3,5-Trimethoxybenzene SCHEMBL28493 | 0.83 | ALDH1A1 (1.00) | ALDH1A1CYP1A1CYP1B1CYP3A4CYP1A2 | |
| 1,3,5-Trimethoxybenzene SCHEMBL28416912 | 0.79 | ALDH1A1 (0.92) | ALDH1A1CYP1A1CYP1B1CYP3A4CYP1A2 | |
| 1,3,5-Trimethoxybenzene SCHEMBL28557531 | 0.79 | ALDH1A1 (0.92) | ALDH1A1CYP1A1CYP1B1CYP3A4CYP1A2 | |
| 1,3,5-Trimethoxybenzene SCHEMBL28740008 | 0.79 | ALDH1A1 (0.92) | ALDH1A1CYP1A1CYP1B1CYP3A4CYP1A2 | |
| SCHEMBL6933949 | 0.78 | ALDH1A1 (0.48) | ALDH1A1CYP1A1CYP1B1CYP3A4CYP1A2 | |
| 1,3,5-Trimethoxybenzene SCHEMBL27603737 | 0.76 | ALDH1A1 (0.85) | ALDH1A1CYP1A1CYP1B1CYP3A4CYP1A2 | |
| 1,3,5-Trimethoxybenzene SCHEMBL27413401 | 0.75 | ALDH1A1 (0.69) | ALDH1A1CYP1A1CYP1B1CYP3A4CYP1A2 | |
| SCHEMBL2947790 | 0.75 | ALDH1A1 (0.42) | ALDH1A1CYP1A1CYP1B1CYP1A2CYP2D6 | |
| SCHEMBL31052 | 0.75 | ALDH1A1 (0.58) | ALDH1A1CYP1A1CYP1B1CYP3A4CYP19A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106209004-A | Frequency chip preparation method based on build micro fabrication | 苏州普锐晶科技有限公司 | 2016-12-07 | — | — | CN | claimed |
| CN-106110358-A | A kind of environment-friendly deodorant agent | 苏州市易柯露环保科技有限公司 | 2016-11-16 | — | — | CN | claimed |
| CN-105348157-B | Cystamine diisocyanate monomer, polymer based on the monomer and its preparation method and application | 苏州大学 | 2018-01-16 | — | — | CN | disclosed |
| CN-106110358-A | A kind of environment-friendly deodorant agent | 苏州市易柯露环保科技有限公司 | 2016-11-16 | — | — | CN | disclosed |