Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | S100A4 | P26447 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | DAO | P14920 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | CCKBR | P32239 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30104893 | 0.88 | CCKBR (0.41) | S100A4ALDH1A1LMNADAOSMN1; SMN2 | |
| SCHEMBL30104876 | 0.87 | CTSB (0.36) | NR2E3MAPK1S100A4ALDH1A1LMNA | |
| SCHEMBL30104902 | 0.86 | S100A4 (0.37) | MAPK1S100A4ALDH1A1LMNADAO | |
| SCHEMBL30104867 | 0.84 | MAPK1 (0.47) | NR2E3THRBMAPK1S100A4ALDH1A1 | |
| SCHEMBL30104872 | 0.83 | POLB (0.38) | S100A4ALDH1A1LMNADAOSMN1; SMN2 | |
| SCHEMBL30104856 | 0.78 | ALDH1A1 (0.35) | THRBMAPK1ALDH1A1 | |
| SCHEMBL30104905 | 0.77 | NPSR1 (0.37) | ALDH1A1LMNADAOHTTCTSB | |
| SCHEMBL30104898 | 0.69 | CCKBR (0.41) | THRBMAPK1S100A4ALDH1A1LMNA | |
| SCHEMBL28393133 | 0.69 | ALDH1A1 (0.38) | THRBMAPK1ALDH1A1 | |
| SCHEMBL30104878 | 0.68 | NUAK1 (0.33) | — |
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-115583927-B | Thioether compound, and preparation method and application thereof | 华南师范大学 | 2024-07-12 | — | — | CN | disclosed |
| CN-115583927-A | Thioether compound and preparation method and application thereof | 华南师范大学 | 2023-01-10 | — | — | CN | disclosed |