Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.31 |
| ▸ | RARB | P10826 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TYR | P14679 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8938953 | 1.00 | ESR2 (0.34) | ESR2CYP3A4CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL8938960 | 1.00 | ESR2 (0.34) | ESR2CYP3A4CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL8938837 | 1.00 | ESR2 (0.34) | ESR2CYP3A4CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL8938956 | 1.00 | ESR2 (0.34) | ESR2CYP3A4CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL8938878 | 1.00 | ESR2 (0.34) | ESR2CYP3A4CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL8938874 | 1.00 | ESR2 (0.34) | ESR2CYP3A4CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL8938959 | 1.00 | ESR2 (0.34) | ESR2CYP3A4CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL8938963 | 1.00 | ESR2 (0.34) | ESR2CYP3A4CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL8938859 | 1.00 | ESR2 (0.34) | ESR2CYP3A4CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL8938914 | 1.00 | ESR2 (0.34) | ESR2CYP3A4CYP2C8CYP2D6CYP2C9 |
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-8187494-B2 | Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device | JNC CORPORATION (JP) | 2012-05-29 | — | — | US | disclosed |