Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 4/20 | 0.33 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.30 |
| ▸ | JAK1 | P23458 | 1/20 | 0.30 |
| ▸ | TYK2 | P29597 | 1/20 | 0.30 |
| ▸ | JAK3 | P52333 | 1/20 | 0.30 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP11B2 | P19099 | 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 | |
|---|---|---|---|---|
| SCHEMBL9008497 | 1.00 | PGR (0.33) | PGRIDO1HTR2AHTR2CHTR2B | |
| SCHEMBL16080751 | 0.85 | ESR2 (0.45) | PGRHTR2AHTR2CHTR2BGRIN2B | |
| SCHEMBL8101984 | 0.85 | ALDH1A1 (0.37) | PGRHTR2AHTR2CHTR2BGRIN2B | |
| SCHEMBL18458568 | 0.85 | HTR2C (0.41) | PGRIDO1HTR2AHTR2CHTR2B | |
| SCHEMBL8101981 | 0.85 | ALDH1A1 (0.37) | PGRHTR2AHTR2CHTR2BGRIN2B | |
| SCHEMBL7765289 | 0.84 | HTR2A (0.40) | IDO1HTR2AHTR2CHTR2BKDM1A | |
| SCHEMBL7765294 | 0.84 | HTR2A (0.40) | IDO1HTR2AHTR2CHTR2BKDM1A | |
| SCHEMBL7936155 | 0.83 | CYP2C9 (0.42) | PGRIDO1CYP11B2 | |
| SCHEMBL7936157 | 0.83 | CYP2C9 (0.42) | PGRIDO1CYP11B2 | |
| SCHEMBL18800297 | 0.82 | HTR2A (0.38) | PGRHTR2AHTR2CHTR2BGRIN2B |
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 |
|---|---|---|---|---|---|---|---|
| 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 |