Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.41 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | PRNP | P04156 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | ADK | P55263 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | PLK1 | P53350 | 1/20 | 0.41 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| Acetone SCHEMBL28388268 | 0.88 | RXFP1 (0.47) | RXFP1HDAC8MMP3NR4A1NR4A2 | |
| Urea SCHEMBL6165063 | 0.80 | KDM4E (0.52) | HDAC8MMP3NR4A1NR4A2NR4A3 | |
| SCHEMBL29405063 | 0.79 | ALDH1A1 (0.53) | HDAC8MMP3NR4A1NR4A2NR4A3 | |
| SCHEMBL8824112 | 0.79 | ALDH1A1 (0.53) | HDAC8MMP3NR4A1NR4A2NR4A3 | |
| SCHEMBL69629 | 0.79 | ALDH1A1 (0.53) | HDAC8MMP3NR4A1NR4A2NR4A3 | |
| SCHEMBL29903148 | 0.79 | ALDH1A1 (0.53) | HDAC8MMP3NR4A1NR4A2NR4A3 | |
| SCHEMBL10418994 | 0.78 | NCEH1 (0.47) | HDAC8MMP3NR4A1NR4A2NR4A3 | |
| Naphthalene SCHEMBL8135433 | 0.77 | ALDH1A1 (0.50) | HDAC8MMP3ALDH1A1HSD17B10HPGD | |
| SCHEMBL9635910 | 0.77 | ALDH1A1 (0.50) | HDAC8MMP3ALDH1A1HSD17B10PRNP | |
| Benzene SCHEMBL28694599 | 0.77 | ALDH1A1 (0.50) | NR4A1NR4A2NR4A3ALDH1A1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116253683-B | Polymerizable humidity and pH responsive fluorescent molecular switch and preparation method and application thereof | 北京大学 | 2024-12-03 | — | — | CN | disclosed |
| CN-116253683-A | Polymerizable humidity and pH responsive fluorescent molecular switch and preparation method and application thereof | 北京大学 | 2023-06-13 | — | — | CN | disclosed |