Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 2/20 | 0.31 |
| ▸ | NOS1 | P29475 | 2/20 | 0.31 |
| ▸ | NOS2 | P35228 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7912234 | 1.00 | SIGMAR1 (0.34) | SIGMAR1CYP1A2NOS3NOS1NOS2 | |
| SCHEMBL10888358 | 0.89 | NOS3 (0.33) | NOS3NOS1NOS2 | |
| SCHEMBL10888364 | 0.89 | NOS3 (0.33) | NOS3NOS1NOS2 | |
| SCHEMBL9013868 | 0.89 | — | — | |
| SCHEMBL9013867 | 0.89 | — | — | |
| SCHEMBL10614556 | 0.87 | CYP1A2 (0.43) | SIGMAR1CYP1A2 | |
| SCHEMBL10614562 | 0.87 | CYP1A2 (0.43) | SIGMAR1CYP1A2 | |
| SCHEMBL7901794 | 0.86 | — | — | |
| SCHEMBL432351 | 0.86 | — | — | |
| SCHEMBL815076 | 0.86 | NOS1 (0.37) | NOS3NOS1NOS2 |
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-0750028-B1 | Alkenylcyclohexane derivatives, liquid crystal composition and liquid crystal display element | CHISSO CORP (JP) | 2001-04-18 | — | — | EP | disclosed |
| US-5776367-A | Alkenylcyclohexane derivatives, liquid crystal composition and liquid crystal display element | CHISSO CORPORATION (JP) | 1998-07-07 | — | — | US | disclosed |
| EP-0750028-A2 | Alkenylcyclohexane derivatives, liquid crystal composition and liquid crystal display element | Chisso Corporation (JP) | 1996-12-27 | — | — | EP | disclosed |