Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL9055508 | 1.00 | TLR4 (0.34) | TLR4CYP1A2MAPT | |
| SCHEMBL6697654 | 0.80 | TLR4 (0.42) | TLR4CYP1A2MAPT | |
| SCHEMBL5836344 | 0.80 | TLR4 (0.42) | TLR4CYP1A2MAPT | |
| SCHEMBL5836340 | 0.80 | TLR4 (0.42) | TLR4CYP1A2MAPT | |
| SCHEMBL9057106 | 0.78 | TLR4 (0.36) | TLR4MAPT | |
| SCHEMBL9057108 | 0.78 | TLR4 (0.36) | TLR4MAPT | |
| SCHEMBL9057114 | 0.78 | TLR4 (0.36) | TLR4MAPT | |
| SCHEMBL11019071 | 0.78 | TLR4 (0.41) | TLR4CYP1A2MAPT | |
| SCHEMBL8217513 | 0.78 | TLR4 (0.41) | TLR4CYP1A2MAPT | |
| SCHEMBL11019067 | 0.78 | TLR4 (0.41) | TLR4CYP1A2MAPT |
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-0735015-A2 | A liquid crystal compound having (a) deuterium atom (s) and a liquid crystal composition comprising the said compound | CHISSO CORPORATION (JP) | 1996-10-02 | — | — | EP | disclosed |