Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 7/20 | 0.33 |
| ▸ | ESR1 | P03372 | 6/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.31 |
| ▸ | CHKA | P35790 | 1/20 | 0.31 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.31 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | APP | P05067 | 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 | |
|---|---|---|---|---|
| SCHEMBL19985428 | 0.92 | CYP2C9 (0.41) | ESR2ESR1CYP2C9CYP3A4FFAR4 | |
| SCHEMBL19985434 | 0.90 | CYP2C9 (0.34) | ESR2CYP2C9FFAR4DGAT1SOAT1 | |
| SCHEMBL19986347 | 0.89 | CYP3A4 (0.40) | CYP2C9CYP3A4FFAR4CHKADGAT1 | |
| SCHEMBL19985453 | 0.88 | MAPT (0.34) | ESR2CYP2C9DGAT1SOAT1ALDH1A1 | |
| SCHEMBL19985447 | 0.88 | MAPT (0.34) | ESR2CYP2C9DGAT1SOAT1ALDH1A1 | |
| SCHEMBL20082924 | 0.88 | ESR2 (0.33) | ESR2ESR1CYP2C9CYP3A4FFAR4 | |
| SCHEMBL22881578 | 0.86 | ESR2 (0.36) | ESR2ESR1CYP2C9CYP3A4FFAR4 | |
| SCHEMBL19129806 | 0.84 | CTSL (0.36) | ESR2ESR1CYP2C9CYP3A4FFAR4 | |
| SCHEMBL19985594 | 0.82 | — | — | |
| SCHEMBL8933753 | 0.82 | CYP3A4 (0.33) | CYP2C9CYP3A4CYP2D6APP |
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-20180079959-A1 | LIQUID CRYSTAL ELEMENT WITH NEGATIVE DIELECTRIC ANISOTROPY | DIC CORPORATION (JP) | 2018-03-22 | — | — | US | disclosed |
| US-20180079959-A1 | LIQUID CRYSTAL ELEMENT WITH NEGATIVE DIELECTRIC ANISOTROPY | DIC CORPORATION (JP) | 2018-03-22 | — | — | US | disclosed |