Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.37 |
| ▸ | ESR1 | P03372 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | USP5 | P45974 | 2/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | CCR2 | P41597 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL7765294 | 1.00 | HTR2A (0.40) | HTR2AHTR2CHTR2BUSP30ESR2 | |
| SCHEMBL808710 | 0.84 | HTR2A (0.46) | HTR2AHTR2CHTR2BUSP30ESR2 | |
| SCHEMBL29389392 | 0.84 | HTR2A (0.46) | HTR2AHTR2CHTR2BUSP30ESR2 | |
| SCHEMBL9008501 | 0.84 | PGR (0.33) | HTR2AHTR2CHTR2BCYP3A4KDM1A | |
| SCHEMBL9008497 | 0.84 | PGR (0.33) | HTR2AHTR2CHTR2BCYP3A4KDM1A | |
| Ammonia Solution, Strong SCHEMBL2142374 | 0.82 | HTR2A (0.44) | HTR2AHTR2CHTR2BUSP30ESR2 | |
| SCHEMBL8467336 | 0.82 | HTR2A (0.40) | HTR2AHTR2CHTR2BUSP30ESR2 | |
| SCHEMBL12228231 | 0.82 | HTR2A (0.40) | HTR2AHTR2CHTR2BUSP30ESR2 | |
| SCHEMBL28710455 | 0.82 | ESR2 (0.58) | HTR2AHTR2CHTR2BUSP30ESR2 | |
| SCHEMBL7767746 | 0.81 | IDO1 (0.33) | ESR2ESR1CYP3A4CYP2C9IDO1 |
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-0727428-B1 | Novel silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions | SHINETSU CHEMICAL CO (JP) | 2001-06-06 | — | — | EP | disclosed |
| US-5665271-A | Silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1997-09-09 | — | — | US | disclosed |
| EP-0727428-A1 | Novel silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1996-08-21 | — | — | EP | disclosed |