Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.32 |
| ▸ | TP53 | P04637 | 3/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | THPO | P40225 | 1/20 | 0.31 |
| ▸ | PPM1B | O75688 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | PPP1CC | P36873 | 1/20 | 0.31 |
| ▸ | TFPI2 | P48307 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8624047 | 1.00 | HSD17B10 (0.33) | HSD17B10ALDH1A1L3MBTL1ESR1ESR2 | |
| SCHEMBL402404 | 1.00 | HSD17B10 (0.33) | HSD17B10ALDH1A1L3MBTL1ESR1ESR2 | |
| SCHEMBL6377360 | 0.97 | MAPK1 (0.32) | HSD17B10ALDH1A1MAPK1TP53CYP3A4 | |
| SCHEMBL430025 | 0.91 | — | — | |
| SCHEMBL2344957 | 0.84 | — | — | |
| SCHEMBL22767562 | 0.79 | ALDH1A1 (0.32) | HSD17B10ALDH1A1MAPK1LMNATSHR | |
| SCHEMBL11466183 | 0.78 | ALDH1A1 (0.37) | HSD17B10ALDH1A1L3MBTL1MAPK1LMNA | |
| SCHEMBL10823232 | 0.78 | HSD17B10 (0.31) | HSD17B10ALDH1A1L3MBTL1ESR1ESR2 | |
| SCHEMBL8590344 | 0.76 | CA1 (0.39) | HSD17B10ALDH1A1MAPK1 | |
| SCHEMBL9247017 | 0.76 | CA1 (0.39) | HSD17B10ALDH1A1MAPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106674161-A | Preparation method of 8-furan-8-oxomethyl octanoate | 浙江工业大学 | 2017-05-17 | — | — | CN | disclosed |