Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | APP | P05067 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | FASN | P49327 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | RARB | P10826 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | SPHK1 | Q9NYA1 | 4/20 | 0.32 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.32 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 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 | |
|---|---|---|---|---|
| SCHEMBL8417102 | 1.00 | CYP3A4 (0.38) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL7757744 | 1.00 | CYP3A4 (0.38) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL8417103 | 1.00 | CYP3A4 (0.38) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL8452703 | 1.00 | CYP3A4 (0.38) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL7757739 | 1.00 | CYP3A4 (0.38) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL8420237 | 0.96 | CYP3A4 (0.38) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL8420593 | 0.96 | CYP3A4 (0.38) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL8032320 | 0.96 | CYP2C9 (0.39) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL7753111 | 0.96 | CYP2C9 (0.39) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL7753108 | 0.96 | CYP2C9 (0.39) | CYP3A4CYP2C9APPCYP2D6CYP2C19 |
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-0799878-A1 | Liquid crystal compositions and liquid crystal display elements containing same | Shin-Etsu Chemical Co., Ltd. (JP) | 1997-10-08 | — | — | EP | disclosed |