Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.52 |
| ▸ | IDO1 | P14902 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 3/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19583372 | 1.00 | HSD17B10 (0.56) | HSD17B10KDM4EIDO1CYP1A2CYP2C9 | |
| SCHEMBL26235227 | 0.92 | HSD17B10 (0.50) | HSD17B10KDM4EIDO1CYP1A2CYP2C9 | |
| SCHEMBL9656750 | 0.90 | KDM4E (0.61) | HSD17B10KDM4EIDO1CYP1A2CYP2C9 | |
| SCHEMBL31080948 | 0.89 | HSD17B10 (0.48) | HSD17B10KDM4EIDO1CYP1A2CYP2C9 | |
| SCHEMBL20398629 | 0.89 | HSD17B10 (0.48) | HSD17B10KDM4EIDO1CYP1A2CYP2C9 | |
| SCHEMBL23271769 | 0.86 | HSD17B10 (0.49) | HSD17B10KDM4EIDO1CYP1A2CYP2C9 | |
| SCHEMBL31081205 | 0.86 | HSD17B10 (0.46) | HSD17B10KDM4EIDO1CYP1A2CYP2C9 | |
| SCHEMBL30003017 | 0.86 | HSD17B10 (0.46) | HSD17B10KDM4EIDO1CYP1A2CYP2C9 | |
| SCHEMBL20398668 | 0.86 | HSD17B10 (0.46) | HSD17B10KDM4EIDO1CYP1A2CYP2C9 | |
| SCHEMBL20398437 | 0.86 | HSD17B10 (0.46) | HSD17B10KDM4EIDO1CYP1A2CYP2C9 |
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 |