Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 8/20 | 0.36 |
| ▸ | ESR1 | P03372 | 6/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.36 |
| ▸ | APP | P05067 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.33 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 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 | |
|---|---|---|---|---|
| SCHEMBL18458621 | 0.88 | DGAT1 (0.37) | ESR2ESR1CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL18458841 | 0.87 | HTR2A (0.34) | ESR2ESR1CYP3A4CYP2C9APP | |
| SCHEMBL17552977 | 0.86 | CYP3A4 (0.38) | ESR2ESR1CYP3A4CYP2C9APP | |
| SCHEMBL18559015 | 0.84 | DGAT1 (0.35) | ESR2ESR1CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL18458901 | 0.84 | HTR2A (0.32) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL17552984 | 0.84 | CYP2C9 (0.46) | ESR2ESR1CYP3A4CYP2C9APP | |
| SCHEMBL17552978 | 0.82 | CYP2C9 (0.39) | ESR2ESR1CYP3A4CYP2C9APP | |
| SCHEMBL19619403 | 0.81 | ESR2 (0.46) | ESR2ESR1CYP3A4CYP2C9APP | |
| SCHEMBL17553493 | 0.81 | ESR2 (0.45) | ESR2CYP3A4CYP2C9APPCYP2D6 | |
| SCHEMBL19619456 | 0.81 | DGAT1 (0.33) | DGAT1FFAR4 |
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-9822304-B2 | Liquid crystal composition and liquid crystal display element containing the same | DIC CORPORATION (JP) | 2017-11-21 | — | — | US | disclosed |