Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 5/20 | 0.49 |
| ▸ | CES1 | P23141 | 6/20 | 0.44 |
| ▸ | FAAH | O00519 | 8/20 | 0.41 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
| ▸ | DGKA | P23743 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9563388 | 0.98 | CES2 (0.46) | CES2CES1FAAHNAAADGKA | |
| SCHEMBL7262141 | 0.92 | CES2 (0.39) | CES2CES1FAAHDGKAMEN1 | |
| SCHEMBL1784672 | 0.84 | LMNA (0.34) | CES2FAAHKMT2AHCAR2 | |
| Fluoride SCHEMBL9617438 | 0.82 | LMNA (0.33) | CES2HCAR2 | |
| Ammonia Solution, Strong SCHEMBL1580153 | 0.82 | LMNA (0.33) | CES2HCAR2 | |
| SCHEMBL24361090 | 0.81 | CES2 (0.52) | CES2CES1FAAHNAAAMEN1 | |
| SCHEMBL24361246 | 0.81 | CES2 (0.52) | CES2CES1FAAHNAAAMEN1 | |
| SCHEMBL24361249 | 0.81 | CES2 (0.52) | CES2CES1FAAHNAAAMEN1 | |
| SCHEMBL24361250 | 0.81 | CES2 (0.52) | CES2CES1FAAHNAAAMEN1 | |
| SCHEMBL24361251 | 0.81 | CES2 (0.52) | CES2CES1FAAHNAAAMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0331367-B1 | Liquid crystal compounds having fluoroalkyl radical | SHOWA SHELL SEKIYU (JP) | 1993-12-08 | — | — | EP | disclosed |
| US-5051527-A | Liquid crystal compounds having fluoroalkyl radical | SHOWA SHELL SEKIYU K.K. (JP) | 1991-09-24 | — | — | US | disclosed |
| EP-0331367-A2 | Liquid crystal compounds having fluoroalkyl radical | Showa Shell Sekiyu Kabushiki Kaisha (JP) | 1989-09-06 | — | — | EP | disclosed |