Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.50 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.49 |
| ▸ | STS | P08842 | 7/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11041886 | 1.00 | CYP2C9 (0.54) | CYP2C9ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL11037720 | 0.99 | ALDH1A1 (0.56) | CYP2C9ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL11038870 | 0.99 | ALDH1A1 (0.56) | CYP2C9ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL11038876 | 0.99 | ALDH1A1 (0.56) | CYP2C9ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL11037718 | 0.99 | ALDH1A1 (0.56) | CYP2C9ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL11041619 | 0.99 | ALDH1A1 (0.56) | CYP2C9ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL11041614 | 0.99 | ALDH1A1 (0.56) | CYP2C9ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL11041650 | 0.97 | CYP2C9 (0.54) | CYP2C9ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL11041648 | 0.97 | CYP2C9 (0.54) | CYP2C9ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL10910005 | 0.96 | CYP2C9 (0.51) | CYP2C9ALDH1A1MAPTNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0118046-A1 | Liquid crystal compounds, liquid crystal compositions and liquid crystal display devices | HITACHI, LTD. (JP) | 1984-09-12 | — | — | EP | disclosed |