Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 4/20 | 0.32 |
| ▸ | PPARA | Q07869 | 4/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.32 |
| ▸ | PLK1 | P53350 | 1/20 | 0.32 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | PPARD | Q03181 | 1/20 | 0.31 |
| ▸ | RARA | P10276 | 1/20 | 0.30 |
| ▸ | RARB | P10826 | 1/20 | 0.30 |
| ▸ | RARG | P13631 | 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 | |
|---|---|---|---|---|
| SCHEMBL7732755 | 0.96 | DAO (0.32) | PPARGPPARAS1PR1DAOPDE2A | |
| SCHEMBL7729257 | 0.93 | THRB (0.33) | THRBPPARGPPARAS1PR1TRPV1 | |
| SCHEMBL7722573 | 0.93 | THRB (0.39) | THRBPPARGPPARAPTGS2PLK1 | |
| SCHEMBL7730440 | 0.92 | THRB (0.39) | THRBPPARGPPARAS1PR1PTGS2 | |
| SCHEMBL7730397 | 0.91 | DAO (0.33) | PPARGPPARADAOPPARD | |
| SCHEMBL7722830 | 0.91 | THRB (0.40) | THRBPPARGPPARAS1PR1PTGS2 | |
| SCHEMBL15317532 | 0.91 | PTGS2 (0.37) | THRBPPARGPPARAS1PR1TRPV1 | |
| SCHEMBL7734949 | 0.91 | PTGS2 (0.37) | THRBPPARGPPARAS1PR1TRPV1 | |
| SCHEMBL7729353 | 0.90 | THRB (0.39) | THRBPPARGPPARAS1PR1PTGS2 | |
| SCHEMBL7732860 | 0.90 | HTR2A (0.41) | THRBPPARGPPARAPTGS2PLK1 |
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-0786445-B1 | DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION | CHISSO CORP (JP) | 2002-07-17 | — | — | EP | disclosed |