Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | ELANE | P08246 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19583393 | 1.00 | TSHR (0.56) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL30004059 | 0.98 | TSHR (0.57) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL20695795 | 0.98 | TSHR (0.57) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL30003019 | 0.98 | TSHR (0.57) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL30004151 | 0.98 | TSHR (0.57) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL23271662 | 0.98 | TSHR (0.57) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL19583397 | 0.98 | TSHR (0.57) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL19583356 | 0.98 | TSHR (0.57) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL20695794 | 0.98 | TSHR (0.57) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL30004024 | 0.98 | TSHR (0.57) | TSHRMAPK1TP53CYP3A4ALDH1A1 |
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 |