Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 5/20 | 0.45 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9747806 | 0.83 | NR3C1 (0.33) | NR3C1 | |
| SCHEMBL19001653 | 0.80 | ACHE (0.46) | MAOBIDO1ALDH1A1CYP2D6TAAR1 | |
| SCHEMBL27835396 | 0.80 | IDO1 (0.46) | MAOBIDO1ALDH1A1CYP2D6TAAR1 | |
| SCHEMBL8463105 | 0.80 | TRPA1 (0.53) | MAOBALDH1A1CYP2D6TAAR1 | |
| SCHEMBL2965433 | 0.77 | TRPA1 (0.47) | MAOBIDO1ALDH1A1CYP2D6TAAR1 | |
| SCHEMBL12032159 | 0.77 | IDO1 (0.48) | MAOBIDO1ALDH1A1CYP2D6TAAR1 | |
| SCHEMBL758533 | 0.75 | ACHE (0.55) | MAOBIDO1TAAR1ACHENR3C1 | |
| SCHEMBL29941639 | 0.75 | ACHE (0.55) | MAOBIDO1TAAR1ACHENR3C1 | |
| SCHEMBL9748789 | 0.74 | IDO1 (0.46) | MAOBIDO1ALDH1A1CYP2D6TAAR1 | |
| SCHEMBL2258137 | 0.72 | TAAR1 (0.59) | MAOBIDO1ALDH1A1TAAR1ACHE |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0217159-B1 | ALDEHYDES, ACETALS, ALCOHOLS AND ETHERS WITH 3-METHYL OR 3,5-DIMETHYLBENZYL GROUPS, THEIR PREPARATION AND THEIR USE AS FRAGRANCE COMPOUNDS | Consortium für elektrochemische Industrie GmbH (DE) | 1992-01-02 | — | — | EP | disclosed |
| US-4710316-A | Aldehydes, acetals, alcohols and ethers having 3-methyl- or 3,5-dimethyl-benzyl groups, their manufacture and perfume materials containing same | CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) | 1987-12-01 | — | — | US | disclosed |
| EP-0217159-A2 | Aldehydes, acetals, alcohols and ethers with 3-methyl or 3,5-dimethylbenzyl groups, their preparation and their use as fragrance compounds | Consortium für elektrochemische Industrie GmbH (DE) | 1987-04-08 | — | — | EP | disclosed |