Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.37 |
| ▸ | SUCNR1 | Q9BXA5 | 1/20 | 0.37 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 4/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 4/20 | 0.31 |
| ▸ | PPARD | Q03181 | 4/20 | 0.31 |
| ▸ | PPARA | Q07869 | 4/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Alcohol SCHEMBL6463809 | 0.88 | — | — | |
| Methyl Alcohol SCHEMBL951377 | 0.88 | — | — | |
| Ethane SCHEMBL10904347 | 0.88 | — | — | |
| SCHEMBL60043 | 0.87 | — | — | |
| SCHEMBL483026 | 0.87 | CYP2D6 (0.56) | FFAR3ALDH1A1ALOX15CYP2D6LMNA | |
| SCHEMBL30781556 | 0.86 | — | — | |
| SCHEMBL17598088 | 0.85 | ALDH1A1 (0.47) | FFAR3ALDH1A1ALOX15CYP2D6LMNA | |
| SCHEMBL9140511 | 0.84 | — | — | |
| SCHEMBL8511067 | 0.84 | — | — | |
| Ammonia Solution, Strong SCHEMBL30916848 | 0.84 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0808100-A1 | NEW PRESERVATIVE COMPOSITION | KEMIRA CHEMICALS OY (FI) | 1997-11-26 | — | — | EP | disclosed |
| WO-1996024247-A1 | NEW PRESERVATIVE COMPOSITION | KEMIRA CHEMICALS OY (FI) | 1996-08-15 | — | — | WO | disclosed |