Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | APP | P05067 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | FASN | P49327 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8022526 | 0.88 | CYP3A4 (0.40) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL8017828 | 0.87 | PDE3B (0.37) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL15298462 | 0.83 | FASN (0.45) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL12820065 | 0.83 | CYP3A4 (0.46) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL8857781 | 0.80 | CYP2C9 (0.42) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL8857786 | 0.80 | CYP2C9 (0.42) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL7762634 | 0.79 | HTR2A (0.40) | SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL8455482 | 0.79 | CYP3A4 (0.40) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL8455485 | 0.79 | CYP3A4 (0.40) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL8451769 | 0.79 | CYP2C9 (0.41) | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0670322-B1 | A silacyclohexane compound, a method of preparing it and a liquid crystal composition containing it | SHINETSU CHEMICAL CO (JP) | 2000-01-19 | — | — | EP | disclosed |
| US-5582764-A | Silacyclohexane compound, a method of preparing it and a liquid crystal composition containing it | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1996-12-10 | — | — | US | disclosed |
| EP-0670322-A1 | A silacyclohexane compound, a method of preparing it and a liquid crystal composition containing it | Shin-Etsu Chemical Co., Ltd. (JP) | 1995-09-06 | — | — | EP | disclosed |