Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL13026099 | 0.83 | S1PR1 (0.30) | CYP2C9ALDH1A1MAPT | |
| SCHEMBL11938475 | 0.82 | F2RL1 (0.30) | — | |
| SCHEMBL7670108 | 0.81 | CYP2C9 (0.36) | CYP2C9OPRL1ALDH1A1LMNAMAPT | |
| SCHEMBL7670105 | 0.81 | CYP2C9 (0.36) | CYP2C9OPRL1ALDH1A1LMNAMAPT | |
| SCHEMBL7670118 | 0.81 | CYP2C9 (0.36) | CYP2C9OPRL1ALDH1A1LMNAMAPT | |
| SCHEMBL12834339 | 0.80 | — | — | |
| SCHEMBL12833694 | 0.80 | CYP2C9 (0.33) | CYP2C9OPRL1ALDH1A1LMNAMAPT | |
| SCHEMBL12907514 | 0.79 | — | — | |
| SCHEMBL12834319 | 0.78 | OPRL1 (0.32) | CYP2C9OPRL1ALDH1A1LMNAMAPT | |
| SCHEMBL10302890 | 0.78 | LNPEP (0.31) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1731493-B1 | BENZENE DERIVATIVE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY | CHISSO CORP (JP) | 2011-03-23 | — | — | EP | disclosed |
| US-7838087-B2 | Benzene derivative, liquid crystal composition and liquid crystal display device | CHISSO CORPORATION (JP) | 2010-11-23 | — | — | US | disclosed |