Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.31 |
| ▸ | NR1H3 | Q13133 | 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 | |
|---|---|---|---|---|
| SCHEMBL4241 | 0.95 | ESR1 (0.34) | ESR1ESR2ALDH1A1CYP3A4MAPK1 | |
| SCHEMBL6391397 | 0.93 | ESR1 (0.33) | ESR1ESR2ALDH1A1CYP3A4MAPK1 | |
| SCHEMBL9815122 | 0.88 | ESR1 (0.35) | ESR1ESR2ALDH1A1CYP3A4MAPK1 | |
| SCHEMBL28398399 | 0.85 | — | — | |
| SCHEMBL16458730 | 0.81 | MAPT (0.33) | ALDH1A1 | |
| SCHEMBL14837511 | 0.78 | TAAR1 (0.34) | — | |
| SCHEMBL12816750 | 0.77 | TP53 (0.39) | ALDH1A1MAPK1 | |
| SCHEMBL12815755 | 0.76 | MEN1 (0.30) | ALDH1A1 | |
| SCHEMBL9812985 | 0.76 | NR1H2 (0.33) | NR1H2NR1H3 | |
| Imidazole SCHEMBL7679091 | 0.76 | ALDH1A1 (0.43) | ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2379636-B1 | COATING OF HYDROXYLATED SURFACES BY GAS PHASE GRAFTING | CARLSBERG AS (DK) | 2016-11-23 | — | — | EP | disclosed |
| EP-2379636-A2 | COATING OF HYDROXYLATED SURFACES BY GAS PHASE GRAFTING | Carlsberg A/S (DK) | 2011-10-26 | — | — | EP | disclosed |
| WO-2010069330-A2 | COATING OF HYDROXYLATED SURFACES BY GAS PHASE GRAFTING | CARLSBERG A/S (DK) | 2010-06-24 | — | — | WO | disclosed |