Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | BLM | P54132 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | APEX1 | P27695 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.41 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Alpha-Naphthylacetate SCHEMBL29372782 | 0.72 | ALDH1A1 (0.66) | KDM4EALDH1A1BLMTDP1GAA | |
| Alpha-Naphthylacetate SCHEMBL76633 | 0.72 | ALDH1A1 (0.66) | KDM4EALDH1A1BLMTDP1GAA | |
| SCHEMBL8219437 | 0.71 | KDM4E (0.56) | KDM4EALDH1A1BLMTDP1GAA | |
| SCHEMBL6688920 | 0.70 | HTT (0.56) | KDM4EALDH1A1BLMTDP1GAA | |
| Alpha-Naphthylacetate SCHEMBL15903555 | 0.70 | ALDH1A1 (0.64) | KDM4EALDH1A1BLMTDP1GAA | |
| Alpha-Naphthylacetate SCHEMBL11320989 | 0.70 | ALDH1A1 (0.64) | KDM4EALDH1A1BLMTDP1GAA | |
| Alpha-Naphthylacetate SCHEMBL14715880 | 0.70 | ALDH1A1 (0.64) | KDM4EALDH1A1BLMTDP1GAA | |
| Alpha-Naphthylacetate SCHEMBL10751544 | 0.70 | ALDH1A1 (0.64) | KDM4EALDH1A1BLMTDP1GAA | |
| Alpha-Naphthylacetate SCHEMBL10751537 | 0.70 | ALDH1A1 (0.64) | KDM4EALDH1A1BLMTDP1GAA | |
| Alpha-Naphthylacetate SCHEMBL14715837 | 0.70 | ALDH1A1 (0.64) | KDM4EALDH1A1BLMTDP1GAA |
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-2426121-A1 | QUATERNARY AMMONIUM SALT COMPOUND | Teijin Pharma Limited (JP) | 2012-03-07 | — | — | EP | disclosed |