Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.60 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.60 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.60 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 2/20 | 0.32 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 2/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1180554 | 0.78 | — | — | |
| SCHEMBL2005231 | 0.73 | ALDH1A1 (0.90) | ALDH1A1CYP3A4ALOX15HIF1ATSHR | |
| SCHEMBL28133271 | 0.73 | — | — | |
| SCHEMBL27898352 | 0.73 | ALDH1A1 (0.60) | ALDH1A1CYP3A4MMP3KIF11ESR1 | |
| SCHEMBL11080419 | 0.73 | KIF11 (0.37) | ALDH1A1CYP3A4MMP3KIF11ESR1 | |
| SCHEMBL11029698 | 0.73 | ALDH1A1 (0.50) | ALDH1A1CYP3A4ALOX15HIF1A | |
| SCHEMBL11675959 | 0.69 | ESR1 (0.39) | ALDH1A1CYP3A4MMP3KIF11ESR1 | |
| Water SCHEMBL8153073 | 0.68 | — | — | |
| Acetonitrile SCHEMBL8836994 | 0.67 | ALDH1A1 (0.75) | ALDH1A1CYP3A4ALOX15HIF1ATSHR | |
| Methyl Alcohol SCHEMBL28639463 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0474561-B1 | Arylalkylamines, process for their preparation and pharmaceutical compositions containing them | SANOFI SA (FR) | 1998-12-09 | — | — | EP | disclosed |
| EP-0220112-B1 | AROMATIC DERIVATIVES SUBSTITUTED BY AN (OMEGA-AMINO)-ALKANOL GROUP WITH AN ANTIMICROBIAL ACTIVITY, THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM | ELF SANOFI (FR) | 1992-04-08 | — | — | EP | disclosed |
| EP-0474561-A1 | Arylalkylamines, process for their preparation and pharmaceutical compositions containing them | SANOFI (FR) | 1992-03-11 | — | — | EP | disclosed |
| EP-0288352-B1 | AROMATIC DERIVATIVES, THEIR PREPARATION AND THEIR USE AS ANTIMICROBICS | SANOFI (FR) | 1991-09-18 | — | — | EP | disclosed |
| EP-0288352-A1 | Aromatic derivatives, their preparation and their use as antimicrobics | SANOFI (FR) | 1988-10-26 | — | — | EP | disclosed |