Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 2/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.42 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TOP2A | P11388 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19583364 | 1.00 | ALDH1A1 (0.52) | ALDH1A1LMNAMAOBALOX5KDM4E | |
| SCHEMBL20398623 | 0.91 | KDM4E (0.44) | ALDH1A1LMNAMAOBALOX5KDM4E | |
| SCHEMBL20398698 | 0.91 | ALDH1A1 (0.44) | ALDH1A1LMNAMAOBALOX5KDM4E | |
| SCHEMBL9656608 | 0.90 | KDM4E (0.47) | ALDH1A1LMNAMAOBALOX5KDM4E | |
| SCHEMBL9658008 | 0.90 | ALDH1A1 (0.46) | ALDH1A1LMNAMAOBALOX5KDM4E | |
| SCHEMBL19583391 | 0.89 | TSHR (0.54) | ALDH1A1LMNAKDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL30004141 | 0.89 | TSHR (0.54) | ALDH1A1LMNAKDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL9658456 | 0.89 | ALDH1A1 (0.45) | ALDH1A1LMNAMAOBALOX5KDM4E | |
| SCHEMBL23271993 | 0.89 | ALDH1A1 (0.45) | ALDH1A1LMNAMAOBALOX5KDM4E | |
| SCHEMBL30002613 | 0.88 | TSHR (0.56) | ALDH1A1LMNAKDM4EHSD17B10SMN1; SMN2 |
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-113454090-B | Compounds having a polycyclic aromatic skeleton and endoperoxide compounds thereof | 川崎化成工业株式会社 | 2024-08-23 | — | — | CN | disclosed |
| CN-110891980-B | Radical polymerization control agent and radical polymerization control method | 川崎化成工业株式会社 | 2022-09-30 | — | — | CN | disclosed |