Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9625923 | 1.00 | TLR4 (0.38) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL1509950 | 1.00 | TLR4 (0.38) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL8753103 | 0.94 | CYP2C9 (0.36) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL2207128 | 0.94 | CYP2C9 (0.36) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL8755971 | 0.91 | CYP2C9 (0.35) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL8755977 | 0.91 | CYP2C9 (0.35) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL8031360 | 0.91 | CYP2C9 (0.35) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL1249367 | 0.88 | CYP1A2 (0.47) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL9060505 | 0.86 | CYP1A2 (0.41) | CYP2C9LMNAMAPTCYP1A2 | |
| SCHEMBL8754355 | 0.86 | CYP1A2 (0.41) | CYP2C9LMNAMAPTCYP1A2 |
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-0325796-B1 | A LIQUID CRYSTAL COMPOUND AND A MIXTURE CONTAINING THE SAME | Chisso Corporation (JP) | 1992-03-11 | — | — | EP | disclosed |
| US-4877548-A | STABLE TO HEAT, LIGHT, ELECTRICITY AND MOISTURE | CHISSO CORPORATION (JP) | 1989-10-31 | — | — | US | disclosed |
| EP-0325796-A1 | A liquid crystal compound and a mixture containing the same | Chisso Corporation (JP) | 1989-08-02 | — | — | EP | disclosed |