Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | RARB | P10826 | 8/20 | 0.38 |
| ▸ | RARA | P10276 | 2/20 | 0.38 |
| ▸ | RARG | P13631 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.32 |
| ▸ | KDM1A | O60341 | 3/20 | 0.32 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 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 | |
|---|---|---|---|---|
| SCHEMBL8836779 | 0.97 | DAO (0.39) | TSHRHSD17B10DAORARBRARA | |
| SCHEMBL8836028 | 0.93 | DAO (0.41) | DAOMEN1ALDH1A1MAPTKMT2A | |
| SCHEMBL8836518 | 0.89 | DAO (0.41) | DAOKCNJ1KCNH2CYP11B1CYP11B2 | |
| SCHEMBL8470570 | 0.88 | TSHR (0.41) | TSHRHSD17B10RARBRARARARG | |
| SCHEMBL7722802 | 0.88 | TSHR (0.55) | TSHRHSD17B10RARBRARARARG | |
| SCHEMBL8836568 | 0.86 | RARB (0.43) | TSHRHSD17B10RARBRARARARG | |
| SCHEMBL8470743 | 0.85 | TSHR (0.37) | TSHRHSD17B10RARBRARARARG | |
| SCHEMBL8470777 | 0.85 | TSHR (0.50) | TSHRHSD17B10DAORARBRARA | |
| SCHEMBL8836400 | 0.85 | RARB (0.45) | TSHRHSD17B10RARBRARARARG | |
| SCHEMBL8836799 | 0.85 | RARB (0.45) | TSHRHSD17B10RARBRARARARG |
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-A1 | DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION | CHISSO CORPORATION (JP) | 1997-07-30 | — | — | EP | disclosed |