Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.45 |
| ▸ | MMP3 | P08254 | 1/20 | 0.45 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.41 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.41 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | CTRC | Q99895 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Biphenyl SCHEMBL8393809 | 0.97 | ALDH1A1 (0.60) | ALDH1A1MAPK1TAAR1CYP1A2CYP3A4 | |
| SCHEMBL10011381 | 0.90 | ALDH1A1 (0.60) | ALDH1A1MAPK1TAAR1CYP1A2CYP3A4 | |
| SCHEMBL30122416 | 0.90 | ALDH1A1 (0.60) | ALDH1A1MAPK1TAAR1CYP1A2CYP3A4 | |
| Benzene SCHEMBL28128746 | 0.89 | ALDH1A1 (0.43) | ALDH1A1MAPK1CYP3A4HSD17B10TDP1 | |
| SCHEMBL49436 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL20240309 | 0.87 | ALDH1A1 (0.56) | ALDH1A1MAPK1TAAR1CYP1A2CYP3A4 | |
| Fluoride SCHEMBL29262360 | 0.87 | ALDH1A1 (0.56) | ALDH1A1MAPK1TAAR1CYP1A2CYP3A4 | |
| SCHEMBL18496760 | 0.85 | — | — | |
| SCHEMBL9641062 | 0.85 | — | — | |
| Water SCHEMBL22231695 | 0.85 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1327635-B1 | Preparation of phenylphosphate esters of 4,4'-biphenol | BROMINE COMPOUNDS LTD (IL) | 2005-08-31 | — | — | EP | claimed |
| WO-2020031545-A1 | RESIN COMPOSITION FOR PRINTED WIRING BOARD, PREPREG, LAMINATED BOARD, METAL FOIL-CLAD LAMINATED BOARD, PRINTED WIRING BOARD, AND MULTILAYER PRINTED WIRING BOARD | 三菱瓦斯化学株式会社 | 2020-02-13 | — | — | WO | disclosed |
| CN-109071874-A | Polyimide composition and polyimide test socket housing | 纳幕尔杜邦公司 | 2018-12-21 | — | — | CN | disclosed |
| CN-106831862-A | Axial chirality monophosphorus ligand of one class chirality bridging and preparation method thereof | 中山大学 | 2017-06-13 | — | — | CN | disclosed |
| CN-101522598-B | Co-production method of n-butanol and isobutyraldehyde | MITSUBISHI CHEM CORP | 2012-06-27 | — | — | CN | disclosed |
| CN-101522598-A | Co-production method of n-butanol and isobutyraldehyde | MITSUBISHI CHEM CORP (JP) | 2009-09-02 | — | — | CN | disclosed |
| CN-1418227-A | Procatalyst containing bidentate ligand, catalyst system and use thereof in olefin polymerization | EASTMAN CHEM CO (US) | 2003-05-14 | — | — | CN | disclosed |