Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 6/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6432024 | 0.78 | ALDH1A1 (0.41) | TP53CYP3A4ALDH1A1MGLL | |
| SCHEMBL377540 | 0.77 | ALDH1A1 (0.57) | TP53CYP3A4ALDH1A1MGLLTSHR | |
| SCHEMBL6064870 | 0.77 | TP53 (0.59) | TP53CYP3A4ALDH1A1MGLLTSHR | |
| SCHEMBL22657946 | 0.75 | ALDH1A1 (0.52) | TP53CYP3A4ALDH1A1MGLLTSHR | |
| SCHEMBL2131194 | 0.75 | TP53 (0.58) | TP53CYP3A4ALDH1A1MGLLTSHR | |
| SCHEMBL14517851 | 0.73 | TSHR (0.44) | TP53CYP3A4ALDH1A1TSHR | |
| SCHEMBL16340361 | 0.73 | ALDH1A1 (0.53) | TP53CYP3A4ALDH1A1MGLLTSHR | |
| SCHEMBL11148779 | 0.72 | ALDH1A1 (0.42) | TP53CYP3A4ALDH1A1MGLL | |
| SCHEMBL8597084 | 0.71 | — | — | |
| SCHEMBL6064874 | 0.71 | TP53 (0.53) | TP53CYP3A4ALDH1A1MGLL |
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-1389631-B1 | Epoxy resin compositions | SHINETSU CHEMICAL CO (JP) | 2005-10-19 | — | — | EP | claimed |