Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 5/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.47 |
| ▸ | NAAA | Q02083 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 7/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.42 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6007688 | 0.93 | ALDH1A1 (0.56) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| SCHEMBL29328876 | 0.93 | ALDH1A1 (0.56) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| Butyl Alcohol SCHEMBL28186017 | 0.93 | ALDH1A1 (0.56) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| Ethylene Glycol SCHEMBL25438245 | 0.93 | NAAA (0.56) | ALDH1A1ATMTSHRHCAR2NAAA | |
| SCHEMBL37837 | 0.92 | ALDH1A1 (0.67) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| SCHEMBL28758644 | 0.90 | ALDH1A1 (0.64) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| SCHEMBL27647582 | 0.90 | ALDH1A1 (0.64) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| SCHEMBL4553342 | 0.90 | ALDH1A1 (0.64) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| SCHEMBL14890682 | 0.90 | ALDH1A1 (0.64) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| Fluoride SCHEMBL29068332 | 0.90 | ALDH1A1 (0.64) | ALDH1A1ATMTSHRHPGDHCAR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0476784-A1 | Processes for the preparation of ethers | UNION CARBIDE CHEMICALS AND PLASTICS COMPANY, INC. (US) | 1992-03-25 | — | — | EP | disclosed |