Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.52 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.43 |
| ▸ | MPO | P05164 | 4/20 | 0.42 |
| ▸ | DAO | P14920 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28344566 | 0.79 | TAAR1 (0.56) | TAAR1IDO1AOC3MPODAO | |
| SCHEMBL13439437 | 0.78 | HSD17B1 (0.36) | TAAR1 | |
| SCHEMBL10049300 | 0.76 | DPP4 (0.46) | HPGDALDH1A1 | |
| SCHEMBL10049308 | 0.76 | MTNR1A (0.45) | HPGD | |
| SCHEMBL12478612 | 0.75 | TAAR1 (0.56) | TAAR1IDO1AOC3MPODAO | |
| SCHEMBL2556909 | 0.75 | TAAR1 (0.56) | TAAR1IDO1AOC3MPODAO | |
| SCHEMBL436798 | 0.75 | TAAR1 (0.56) | TAAR1IDO1AOC3MPODAO | |
| SCHEMBL7563209 | 0.75 | TAAR1 (0.56) | TAAR1IDO1AOC3MPODAO | |
| SCHEMBL29373563 | 0.75 | TAAR1 (0.56) | TAAR1IDO1AOC3MPODAO | |
| SCHEMBL8526001 | 0.75 | TAAR1 (0.75) | TAAR1IDO1AOC3MPODAO |
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 |