Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | GMNN | O75496 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | THPO | P40225 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CETP | P11597 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Butyl Alcohol SCHEMBL6045192 | 0.89 | ALDH1A1 (0.69) | ALDH1A1SMN1; SMN2LMNATSHRHSD17B10 | |
| Butyl Alcohol SCHEMBL7422679 | 0.89 | — | — | |
| Butyl Alcohol SCHEMBL601846 | 0.89 | — | — | |
| Hexane SCHEMBL1889283 | 0.87 | TSHR (0.48) | ALDH1A1SMN1; SMN2LMNATSHRHSD17B10 | |
| Butyl Alcohol SCHEMBL5571431 | 0.87 | ALDH1A1 (0.73) | ALDH1A1SMN1; SMN2LMNATSHRHSD17B10 | |
| Butyl Alcohol SCHEMBL195732 | 0.87 | — | — | |
| Heptane SCHEMBL2836497 | 0.84 | SPHK1 (0.50) | ALDH1A1LMNATSHRHSD17B10MEN1 | |
| Butyl Alcohol SCHEMBL27647661 | 0.84 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2LMNATSHRHSD17B10 | |
| Butyl Alcohol SCHEMBL1440709 | 0.84 | ALDH1A1 (0.69) | ALDH1A1SMN1; SMN2LMNATSHRHSD17B10 | |
| Butyl Alcohol SCHEMBL633562 | 0.84 | ALDH1A1 (0.69) | ALDH1A1SMN1; SMN2LMNATSHRHSD17B10 |
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-110420299-B | Processing method and application of coix seeds | 北京联合大学 | 2021-06-08 | — | — | CN | disclosed |
| CN-110420299-A | A kind of concocting method and its application of Semen Coicis | UNIV BEIJING UNION | 2019-11-08 | — | — | CN | disclosed |