Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRA | P25101 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27496096 | 0.78 | ALDH1A1 (0.50) | EDNRAALDH1A1HSD17B10TDP1CYP3A4 | |
| SCHEMBL27567430 | 0.78 | ALDH1A1 (0.53) | EDNRAALDH1A1HSD17B10TDP1CYP3A4 | |
| SCHEMBL9570604 | 0.77 | HDAC3 (0.49) | — | |
| SCHEMBL13144311 | 0.75 | ALDH1A1 (0.44) | EDNRAALDH1A1HSD17B10TDP1CYP3A4 | |
| SCHEMBL11099197 | 0.75 | EDNRA (0.48) | EDNRAALDH1A1HSD17B10TDP1CYP3A4 | |
| SCHEMBL12086931 | 0.75 | SLC6A4 (0.46) | CYP3A4CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL13440329 | 0.75 | SLC6A4 (0.46) | CYP3A4CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL27436315 | 0.75 | EDNRA (0.50) | EDNRAALDH1A1HSD17B10TDP1CYP3A4 | |
| SCHEMBL13226837 | 0.75 | CYP2D6 (0.48) | CYP3A4CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL27444135 | 0.75 | ALDH1A1 (0.50) | EDNRAALDH1A1HSD17B10TDP1CYP3A4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103242284-B | A kind of synthetic method of 5-trifluoromethyl piperonylaldehyde of palladium chtalyst | TASLY PHARMACEUTICAL GROUP CO., LTD. (CN) | 2015-12-16 | — | — | CN | disclosed |
| CN-103242284-A | Palladium-catalyzed 5-trifluoromethylpiperonal synthesis method | TASLY PHARMACEUTICAL GROUP CO | 2013-08-14 | — | — | CN | disclosed |
| EP-0545891-A2 | Aldehyde compounds and derivatives thereof useful as intermediates in the preparation of insectical ether compounds | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1993-06-09 | — | — | EP | disclosed |
| US-4840971-A | INSECTICIDES, MITICIDES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1989-06-20 | — | — | US | disclosed |
| EP-0240978-A2 | Ether compounds, process for their preparation, compositions containing the same and use thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1987-10-14 | — | — | EP | disclosed |