Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP3 | P08254 | 1/20 | 0.58 |
| ▸ | KIF11 | P52732 | 3/20 | 0.52 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CA3 | P07451 | 1/20 | 0.46 |
| ▸ | CA6 | P23280 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.42 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7467123 | 1.00 | MMP3 (0.58) | MMP3KIF11CA12CA2CA9 | |
| SCHEMBL82069 | 0.92 | — | — | |
| Water SCHEMBL11055485 | 0.86 | MMP3 (0.74) | MMP3KIF11CA12CA2CA9 | |
| SCHEMBL26246 | 0.86 | MMP3 (0.74) | MMP3KIF11CA12CA2CA9 | |
| SCHEMBL396846 | 0.86 | MMP3 (0.74) | MMP3KIF11CA12CA2CA9 | |
| SCHEMBL13063633 | 0.86 | MMP3 (0.74) | MMP3KIF11CA12CA2CA9 | |
| SCHEMBL29001482 | 0.84 | CYP2A6 (0.46) | MMP3KIF11CA12CA2CA9 | |
| SCHEMBL7019241 | 0.84 | HDAC2 (0.46) | MMP3KIF11CA12CA2CA9 | |
| SCHEMBL23625546 | 0.83 | MMP3 (0.52) | MMP3KIF11CA12CA2CA9 | |
| SCHEMBL18873994 | 0.83 | MMP3 (0.41) | MMP3KIF11CA12CA2CA9 |
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-7575788-B2 | functionation of polyvinyl alcohol with 4'-(11,11-diethoxy-undecyloxy)-biphenyl-4-carbonitrile (side-chain precursor) and octanal; sandwiching a liquid crystal layer between two substrates, one of which have above polymer, arranged so that said surface-director alignment layer facing liquid crystal layer | ECSIBEO PPF2 AB (SE) | 2009-08-18 | — | — | US | disclosed |