Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.34 |
| ▸ | THRA | P10827 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 3/20 | 0.33 |
| ▸ | PPARA | Q07869 | 3/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | RARB | P10826 | 2/20 | 0.33 |
| ▸ | RARA | P10276 | 1/20 | 0.33 |
| ▸ | RARG | P13631 | 1/20 | 0.33 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.32 |
| ▸ | MGAT2 | Q10469 | 1/20 | 0.32 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL7730751 | 0.97 | S1PR1 (0.34) | TSHRHSD17B10S1PR1THRBTHRA | |
| SCHEMBL7729800 | 0.92 | AR (0.33) | MEN1ALDH1A1KMT2A | |
| SCHEMBL7731170 | 0.92 | TSHR (0.41) | TSHRHSD17B10S1PR1PPARGPPARA | |
| SCHEMBL7729948 | 0.91 | S1PR1 (0.33) | TSHRHSD17B10S1PR1THRBTHRA | |
| SCHEMBL7722550 | 0.89 | HSD17B10 (0.39) | TSHRHSD17B10S1PR1THRBTHRA | |
| SCHEMBL7730411 | 0.89 | HSD17B10 (0.39) | TSHRHSD17B10S1PR1THRBTHRA | |
| SCHEMBL7733182 | 0.89 | DAO (0.33) | TSHR | |
| SCHEMBL7732832 | 0.88 | KIF11 (0.36) | TSHRHSD17B10S1PR1PPARGPPARA | |
| SCHEMBL7729099 | 0.88 | HTR2A (0.37) | HSD17B10S1PR1THRBTHRAPPARG | |
| SCHEMBL7732803 | 0.87 | S1PR1 (0.31) | S1PR1S1PR3 |
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 |