Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | TLR4 | O00206 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL7911892 | 1.00 | CYP1A2 (0.35) | CYP1A2TLR4HTTLMNAMAPK1 | |
| SCHEMBL7911906 | 1.00 | CYP1A2 (0.35) | CYP1A2TLR4HTTLMNAMAPK1 | |
| SCHEMBL7911897 | 1.00 | CYP1A2 (0.35) | CYP1A2TLR4HTTLMNAMAPK1 | |
| SCHEMBL7909084 | 0.94 | CYP1A2 (0.39) | CYP1A2HTTLMNAMAPK1PKM | |
| SCHEMBL7909078 | 0.94 | CYP1A2 (0.39) | CYP1A2HTTLMNAMAPK1PKM | |
| SCHEMBL7912011 | 0.94 | TLR4 (0.37) | CYP1A2TLR4HTTLMNAMAPK1 | |
| SCHEMBL31378079 | 0.94 | TLR4 (0.37) | CYP1A2TLR4HTTLMNAMAPK1 | |
| SCHEMBL9057102 | 0.94 | TLR4 (0.37) | CYP1A2TLR4HTTLMNAMAPK1 | |
| SCHEMBL26445645 | 0.94 | TLR4 (0.37) | CYP1A2TLR4HTTLMNAMAPK1 | |
| SCHEMBL7909255 | 0.93 | CYP1A2 (0.39) | CYP1A2HTTLMNAMAPK1PKM |
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 |