Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | DRD5 | P21918 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8415947 | 0.95 | MAP1LC3B (0.35) | S1PR1L3MBTL1SLC6A3HTR1ADRD2 | |
| SCHEMBL8415948 | 0.95 | MAP1LC3B (0.35) | S1PR1L3MBTL1SLC6A3HTR1ADRD2 | |
| SCHEMBL14064214 | 0.79 | PTGS2 (0.41) | S1PR1MAOBPTGS2PTGS1L3MBTL1 | |
| SCHEMBL8396919 | 0.77 | PTGS2 (0.38) | MAOBPTGS2PTGS1HTR1ADRD2 | |
| SCHEMBL7757129 | 0.77 | PTGS2 (0.35) | MAOBPTGS2PTGS1HTR1ADRD2 | |
| SCHEMBL7757127 | 0.77 | PTGS2 (0.35) | MAOBPTGS2PTGS1HTR1ADRD2 | |
| SCHEMBL7756330 | 0.74 | PTGS2 (0.33) | MAOBPTGS2PTGS1HTR1ADRD2 | |
| SCHEMBL7756333 | 0.74 | PTGS2 (0.33) | MAOBPTGS2PTGS1HTR1ADRD2 | |
| SCHEMBL8015111 | 0.74 | MAOB (0.44) | MAOB | |
| SCHEMBL10947296 | 0.73 | ESR2 (0.57) | MAOBPTGS2PTGS1MAP1LC3BNPC1 |
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 |