Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.34 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.34 |
| ▸ | LSS | P48449 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 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 | |
|---|---|---|---|---|
| SCHEMBL8018217 | 1.00 | DRD2 (0.43) | DRD2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL8018213 | 1.00 | DRD2 (0.43) | DRD2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL8018219 | 1.00 | DRD2 (0.43) | DRD2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL7767108 | 0.91 | DRD2 (0.44) | DRD2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL7767101 | 0.91 | DRD2 (0.44) | DRD2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL7767106 | 0.91 | DRD2 (0.44) | DRD2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL7758015 | 0.87 | DRD2 (0.43) | DRD2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL7758007 | 0.87 | DRD2 (0.43) | DRD2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL8418734 | 0.87 | DRD2 (0.43) | DRD2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL8014285 | 0.86 | DRD2 (0.46) | DRD2CYP2C9LMNAMAPTMEN1 |
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 1 patent. 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 |