Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 2/20 | 0.35 |
| ▸ | FASN | P49327 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.30 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.30 |
| ▸ | PIK3C3 | Q8NEB9 | 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 | |
|---|---|---|---|---|
| SCHEMBL13614928 | 0.83 | — | — | |
| SCHEMBL10071714 | 0.80 | APP (0.38) | APPFASNCYP3A4CYP2C9CYP2D6 | |
| SCHEMBL10072001 | 0.80 | APP (0.38) | APPFASNCYP3A4CYP2C9CYP2D6 | |
| SCHEMBL12975807 | 0.80 | APP (0.38) | APPFASNCYP3A4CYP2C9CYP2D6 | |
| SCHEMBL19393910 | 0.80 | APP (0.35) | APPFASNCYP3A4CYP2C9CYP2D6 | |
| SCHEMBL13128386 | 0.79 | CYP2C9 (0.43) | APPFASNCYP3A4CYP2C9CYP2D6 | |
| SCHEMBL19646103 | 0.79 | DPP4 (0.33) | APPFASNCYP3A4CYP2C9CYP2D6 | |
| SCHEMBL19844726 | 0.79 | FASN (0.36) | APPFASNCYP3A4CYP2C9CYP2D6 | |
| SCHEMBL12975940 | 0.79 | HCRTR2 (0.33) | FASN | |
| SCHEMBL10072007 | 0.79 | GRM2 (0.31) | FASN |
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 |