Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.58 |
| ▸ | PKM | P14618 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 8/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.57 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9426502 | 0.99 | ALDH1A1 (0.59) | ALDH1A1HTTCYP2C19KDM4EPKM | |
| SCHEMBL9154459 | 0.87 | ALDH1A1 (0.56) | ALDH1A1HTTCYP2C19KDM4EPKM | |
| SCHEMBL9154894 | 0.85 | CYP2C19 (0.61) | ALDH1A1HTTCYP2C19KDM4EPKM | |
| SCHEMBL9426259 | 0.84 | CYP2C19 (0.60) | ALDH1A1HTTCYP2C19KDM4EPKM | |
| SCHEMBL10858976 | 0.84 | CYP2C19 (0.69) | ALDH1A1HTTCYP2C19KDM4EPKM | |
| SCHEMBL10858979 | 0.84 | CYP2C19 (0.69) | ALDH1A1HTTCYP2C19KDM4EPKM | |
| SCHEMBL9158845 | 0.83 | CYP2C19 (0.71) | ALDH1A1HTTCYP2C19KDM4EPKM | |
| SCHEMBL9160121 | 0.83 | CYP2C19 (0.71) | ALDH1A1HTTCYP2C19KDM4EPKM | |
| Hydrochloric Acid SCHEMBL10859968 | 0.83 | CYP2C19 (0.67) | ALDH1A1HTTCYP2C19KDM4EPKM | |
| Hydrochloric Acid SCHEMBL10859963 | 0.83 | CYP2C19 (0.67) | ALDH1A1HTTCYP2C19KDM4EPKM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0533516-B1 | Amides of 1-(alkoxybenzyl)piperazines, processes for their preparation and pharmaceutical compositions containing them | ADIR (FR) | 1995-02-08 | — | — | EP | disclosed |
| US-5340809-A | Antihypoxic, antiischemic agents | ADIR ET COMPAGNIE (FR) | 1994-08-23 | — | — | US | disclosed |
| EP-0533516-A2 | Amides of 1-(alkoxybenzyl)piperazines, processes for their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1993-03-24 | — | — | EP | disclosed |