Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 3/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.37 |
| ▸ | PPARG | P37231 | 3/20 | 0.34 |
| ▸ | PPARA | Q07869 | 2/20 | 0.34 |
| ▸ | DAO | P14920 | 2/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | RARB | P10826 | 2/20 | 0.32 |
| ▸ | RARA | P10276 | 1/20 | 0.32 |
| ▸ | RARG | P13631 | 1/20 | 0.32 |
| ▸ | CETP | P11597 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7729099 | 0.96 | HTR2A (0.37) | S1PR1S1PR3PPARGPPARAFAAH | |
| SCHEMBL7729833 | 0.92 | DAO (0.34) | S1PR1S1PR3PPARGDAOALOX5 | |
| SCHEMBL7722692 | 0.91 | SKP2 (0.35) | S1PR1S1PR3PPARGPPARADAO | |
| SCHEMBL7732669 | 0.90 | RARB (0.38) | S1PR1S1PR3PPARGPPARASKP2 | |
| SCHEMBL7722876 | 0.90 | S1PR1 (0.36) | S1PR1S1PR3PPARGPPARADAO | |
| SCHEMBL7731530 | 0.89 | S1PR1 (0.33) | S1PR1S1PR3PPARGPPARASKP2 | |
| SCHEMBL7732511 | 0.89 | PPARG (0.35) | S1PR1S1PR3PPARGPPARADAO | |
| SCHEMBL7722606 | 0.88 | DAO (0.36) | PPARGDAOALOX5 | |
| SCHEMBL14226660 | 0.88 | RARB (0.39) | S1PR1S1PR3RARBRARARARG | |
| SCHEMBL7730751 | 0.87 | S1PR1 (0.34) | S1PR1S1PR3PPARGPPARADAO |
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 |