Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PPARA | Q07869 | 1/20 | 0.30 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.30 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.30 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23663912 | 0.81 | SLC6A2 (0.32) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL23663946 | 0.78 | RARB (0.33) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL23663896 | 0.78 | CYP17A1 (0.38) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL23663963 | 0.77 | MAOB (0.40) | — | |
| SCHEMBL7779351 | 0.77 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3DAO | |
| SCHEMBL7779344 | 0.77 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3DAO | |
| SCHEMBL7782195 | 0.75 | SPHK2 (0.36) | SLC6A2SLC6A4SLC6A3DAOHCRTR1 | |
| SCHEMBL7782203 | 0.75 | SPHK2 (0.36) | SLC6A2SLC6A4SLC6A3DAOHCRTR1 | |
| SCHEMBL20259458 | 0.75 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3DAOCHRM5 | |
| SCHEMBL7781718 | 0.74 | SPHK2 (0.37) | SLC6A2SLC6A4SLC6A3DAO |
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-2116522-A1 | PENTACYCLIC LIQUID CRYSTAL COMPOUND HAVING CF<SB>2</SB>O BONDING GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY | Chisso Corporation (JP) | 2009-11-11 | — | — | EP | disclosed |