Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.60 |
| ▸ | CACNA1G | O43497 | 6/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | PPARD | Q03181 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.44 |
| ▸ | SCN1A | P35498 | 2/20 | 0.44 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5698938 | 1.00 | AR (0.60) | ARCACNA1GKCNH2CYP2D6HTT | |
| SCHEMBL6228324 | 0.84 | AR (0.61) | ARCYP2D6HTTMAPK1TSHR | |
| SCHEMBL6259859 | 0.84 | CACNA1G (0.53) | CACNA1GKCNH2CYP2D6HTTHIF1A | |
| SCHEMBL5973845 | 0.84 | APP (0.46) | ARCACNA1GPPARDALDH1A1MAOB | |
| SCHEMBL19273349 | 0.83 | ALDH1A1 (0.49) | CACNA1GKCNH2CYP2D6HTTHIF1A | |
| SCHEMBL12363856 | 0.82 | AR (0.85) | ARCYP2D6HTTHIF1AMAPK1 | |
| SCHEMBL868711 | 0.82 | AR (0.85) | ARCYP2D6HTTHIF1AMAPK1 | |
| SCHEMBL13761600 | 0.82 | AR (0.69) | ARHTTHIF1AMAPK1TSHR | |
| SCHEMBL7019849 | 0.81 | PPARD (0.47) | ARCACNA1GTSHRPPARDALDH1A1 | |
| SCHEMBL12570312 | 0.81 | AR (0.82) | ARCYP2D6HTTHIF1AMAPK1 |
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-1673463-A1 | METHOD FOR TRANSFORMING EPOXY CARRIER OF TRIFLUOROMETHYL GROUPS | Rhodia Chimie (FR) | 2006-06-28 | — | — | EP | disclosed |
| WO-2005038036-A1 | METHOD FOR TRANSFORMING EPOXY CARRIER OF TRIFLUOROMETHYL GROUPS | RHODIA CHIMIE (FR) | 2005-04-28 | — | — | WO | disclosed |