Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 7/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.34 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | CPS1 | P31327 | 2/20 | 0.33 |
| ▸ | HTR6 | P50406 | 2/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | ACACA | Q13085 | 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 | |
|---|---|---|---|---|
| SCHEMBL13586397 | 0.93 | HCRTR2 (0.35) | NAAAHTR1AKCNH2CACNA2D1CACNA2D2 | |
| SCHEMBL14766817 | 0.93 | NAAA (0.39) | NAAAHTR1AKCNH2HCRTR2MAOA | |
| SCHEMBL12740275 | 0.91 | NAAA (0.38) | NAAAHTR1AKCNH2HCRTR2MAOA | |
| SCHEMBL12718994 | 0.91 | NAAA (0.44) | NAAAHTR1AHCRTR2MAOAMAOB | |
| SCHEMBL12740270 | 0.90 | NAAA (0.37) | NAAAHTR1AKCNH2HCRTR2MAOA | |
| SCHEMBL14766940 | 0.89 | NAAA (0.37) | NAAAHTR1AMAOAMAOBHTR6 | |
| SCHEMBL12740271 | 0.88 | NAAA (0.36) | NAAAHTR1AKCNH2MAOAMAOB | |
| SCHEMBL12740277 | 0.88 | NAAA (0.36) | NAAAHTR1AKCNH2MAOAMAOB | |
| SCHEMBL14767021 | 0.88 | NAAA (0.40) | NAAA | |
| SCHEMBL12823508 | 0.87 | FFAR4 (0.40) | NAAAKCNH2MAOBHTR6ACACA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8394294-B2 | Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device | JNC CORPORATION (JP) | 2013-03-12 | — | — | US | disclosed |
| EP-2305627-A1 | TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT | Chisso Corporation (JP) | 2011-04-06 | — | — | EP | disclosed |