Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 4/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | KIF11 | P52732 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | MLNR | O43193 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | PGR | P06401 | 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 | |
|---|---|---|---|---|
| SCHEMBL8019285 | 1.00 | CYP17A1 (0.37) | CYP17A1CYP11B1CYP11B2GPR84MAOB | |
| SCHEMBL8019284 | 1.00 | CYP17A1 (0.37) | CYP17A1CYP11B1CYP11B2GPR84MAOB | |
| SCHEMBL8436863 | 0.90 | CNR1 (0.35) | GPR84MAOBCNR1 | |
| SCHEMBL8436865 | 0.90 | CNR1 (0.35) | GPR84MAOBCNR1 | |
| SCHEMBL8436860 | 0.90 | CNR1 (0.35) | GPR84MAOBCNR1 | |
| SCHEMBL8768381 | 0.85 | CYP17A1 (0.41) | CYP17A1CYP11B1CYP11B2GPR84MAOB | |
| SCHEMBL8768373 | 0.85 | CYP17A1 (0.41) | CYP17A1CYP11B1CYP11B2GPR84MAOB | |
| SCHEMBL8006018 | 0.83 | CYP17A1 (0.34) | CYP17A1CYP11B1CYP11B2GPR84MAOB | |
| SCHEMBL7756524 | 0.83 | CYP17A1 (0.34) | CYP17A1CYP11B1CYP11B2GPR84MAOB | |
| SCHEMBL8006014 | 0.83 | CYP17A1 (0.34) | CYP17A1CYP11B1CYP11B2GPR84MAOB |
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 |