Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 4/20 | 0.36 |
| ▸ | CTSK | P43235 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | ALPL | P05186 | 1/20 | 0.33 |
| ▸ | ALPI | P09923 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.32 |
| ▸ | RARB | P10826 | 2/20 | 0.32 |
| ▸ | RARA | P10276 | 1/20 | 0.32 |
| ▸ | RARG | P13631 | 1/20 | 0.32 |
| ▸ | FASN | P49327 | 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 | |
|---|---|---|---|---|
| SCHEMBL7729299 | 0.93 | TSHR (0.40) | MEN1ALDH1A1MAPTKMT2ACTSS | |
| SCHEMBL7722737 | 0.92 | TSHR (0.45) | MEN1ALDH1A1MAPTKMT2ATSHR | |
| SCHEMBL7733192 | 0.92 | ALPL (0.34) | MEN1ALDH1A1MAPTKMT2ANPSR1 | |
| SCHEMBL7731469 | 0.91 | PPARA (0.34) | PPARGPPARDPPARADHODHFASN | |
| SCHEMBL7731387 | 0.91 | ALPL (0.34) | MEN1ALDH1A1MAPTKMT2ANPSR1 | |
| SCHEMBL12623096 | 0.87 | RARB (0.43) | MEN1ALDH1A1KMT2ATSHRHSD17B10 | |
| SCHEMBL14226547 | 0.87 | MAOB (0.37) | HSD17B10MAOBPPARGPPARDPPARA | |
| SCHEMBL7729622 | 0.87 | MAOB (0.37) | HSD17B10MAOBPPARGPPARDPPARA | |
| SCHEMBL12977414 | 0.86 | MAOB (0.32) | MAOBPPARGPPARDPPARARARB | |
| SCHEMBL7734937 | 0.86 | KIF11 (0.38) | MEN1ALDH1A1MAPTKMT2ANPSR1 |
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-0786445-B1 | DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION | CHISSO CORP (JP) | 2002-07-17 | — | — | EP | disclosed |
| EP-0786445-A1 | DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION | CHISSO CORPORATION (JP) | 1997-07-30 | — | — | EP | disclosed |