Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | MLYCD | O95822 | 1/20 | 0.37 |
| ▸ | GPR3 | P46089 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12829128 | 1.00 | ACHE (0.42) | ACHETSHRCA1CA2CA9 | |
| SCHEMBL13104749 | 1.00 | ACHE (0.42) | ACHETSHRCA1CA2CA9 | |
| SCHEMBL10018707 | 0.94 | ACHE (0.38) | ACHETSHRCA1CA2CA9 | |
| SCHEMBL7729109 | 0.94 | ACHE (0.45) | ACHETSHRKIF11KCNH2BCHE | |
| SCHEMBL12152581 | 0.94 | ACHE (0.38) | ACHETSHRCA1CA2CA9 | |
| SCHEMBL25120146 | 0.92 | ACHE (0.58) | ACHECA1CA2CA9KIF11 | |
| SCHEMBL13038185 | 0.92 | ACHE (0.58) | ACHECA1CA2CA9KIF11 | |
| SCHEMBL13808361 | 0.89 | KCNH2 (0.39) | ACHETSHRCA1CA2CA9 | |
| SCHEMBL13808375 | 0.89 | KCNH2 (0.39) | ACHETSHRCA1CA2CA9 | |
| SCHEMBL13808348 | 0.89 | GRM5 (0.39) | ACHETSHRCA1CA2CA9 |
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 |