Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 2/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 2/20 | 0.34 |
| ▸ | PPARA | Q07869 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7735808 | 0.97 | S1PR1 (0.40) | S1PR1S1PR3CACNA1HPPARGPPARA | |
| SCHEMBL7732575 | 0.96 | S1PR1 (0.35) | S1PR1S1PR3CACNA1HPPARGPPARA | |
| SCHEMBL7730786 | 0.94 | HTR2A (0.35) | S1PR1S1PR3CACNA1HPPARGPPARA | |
| SCHEMBL7731646 | 0.92 | CACNA1H (0.36) | S1PR1S1PR3CACNA1HPPARGBACE1 | |
| SCHEMBL7722798 | 0.92 | S1PR1 (0.37) | S1PR1S1PR3CACNA1HPPARGPPARA | |
| SCHEMBL7729545 | 0.92 | RARB (0.43) | S1PR1S1PR3CACNA1H | |
| SCHEMBL7730764 | 0.91 | S1PR1 (0.38) | S1PR1S1PR3CACNA1HPPARGPPARA | |
| SCHEMBL7731641 | 0.90 | CACNA1H (0.36) | S1PR1S1PR3CACNA1HPPARA | |
| SCHEMBL7722503 | 0.88 | RARB (0.39) | S1PR1S1PR3CACNA1HPPARGPPARA | |
| SCHEMBL7734852 | 0.88 | HTR2A (0.34) | S1PR1PPARGPPARAHTR2ABACE1 |
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 |