Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.45 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.35 |
| ▸ | MIF | P14174 | 1/20 | 0.33 |
| ▸ | FNTA | P49354 | 1/20 | 0.33 |
| ▸ | FNTB | P49356 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| 1,5-Pentanediol SCHEMBL8988957 | 1.00 | GPR84 (0.45) | GPR84FFAR1FFAR4LMNAALDH1A1 | |
| 1,6-Hexanediol SCHEMBL28194476 | 1.00 | GPR84 (0.45) | GPR84FFAR1FFAR4LMNAALDH1A1 | |
| 1,4-Butanediol SCHEMBL2165950 | 0.96 | — | — | |
| 1,3-Propanediol SCHEMBL1399806 | 0.88 | — | — | |
| Octanol SCHEMBL28176901 | 0.85 | TSHR (0.72) | LMNAALDH1A1TSHRHSD17B10MEN1 | |
| 1,6-Hexanediol SCHEMBL3387365 | 0.85 | GPR84 (0.48) | GPR84FFAR1FFAR4LMNAALDH1A1 | |
| Cetyl Alcohol SCHEMBL8359228 | 0.85 | TSHR (0.72) | LMNAALDH1A1TSHRHSD17B10MEN1 | |
| 1-Hexanol SCHEMBL1047802 | 0.85 | TSHR (0.72) | LMNAALDH1A1TSHRHSD17B10MEN1 | |
| Tridecan-1-Ol SCHEMBL9863316 | 0.85 | TSHR (0.72) | LMNAALDH1A1TSHRHSD17B10MEN1 | |
| Ethylene Glycol SCHEMBL27361208 | 0.79 | TSHR (0.50) | TSHR |
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-110357782-B | Preparation method of medium-long chain fatty alcohol and ester thereof | 中国科学技术大学 | 2022-03-01 | — | — | CN | disclosed |
| CN-108409560-B | 1, 13-tridecanediol ester and preparation method of 1, 13-tridecanediol thereof | 合肥利夫生物科技有限公司 | 2021-04-06 | — | — | CN | disclosed |