Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | ADH1B | P00325 | 1/20 | 0.32 |
| ▸ | ADH1C | P00326 | 1/20 | 0.32 |
| ▸ | ADH1A | P07327 | 1/20 | 0.32 |
| ▸ | ADH4 | P08319 | 1/20 | 0.32 |
| ▸ | ADH7 | P40394 | 1/20 | 0.32 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Hexadecane SCHEMBL27925858 | 0.89 | ALDH1A1 (0.39) | ALDH1A1CA1RECQLGLAHPGD | |
| SCHEMBL287823 | 0.88 | — | — | |
| SCHEMBL11218891 | 0.81 | ALDH1A1 (0.50) | ALDH1A1CA1RECQLGLAHPGD | |
| SCHEMBL36624 | 0.81 | ALDH1A1 (0.50) | ALDH1A1CA1RECQLGLAHPGD | |
| SCHEMBL11232260 | 0.81 | ALDH1A1 (0.50) | ALDH1A1CA1RECQLGLAHPGD | |
| SCHEMBL1774885 | 0.81 | ALDH1A1 (0.50) | ALDH1A1CA1RECQLGLAHPGD | |
| SCHEMBL2905917 | 0.81 | ALDH1A1 (0.50) | ALDH1A1CA1RECQLGLAHPGD | |
| SCHEMBL324700 | 0.81 | ALDH1A1 (0.50) | ALDH1A1CA1RECQLGLAHPGD | |
| SCHEMBL273330 | 0.81 | ALDH1A1 (0.50) | ALDH1A1CA1RECQLGLAHPGD | |
| SCHEMBL9542975 | 0.81 | ALDH1A1 (0.50) | ALDH1A1CA1RECQLGLAHPGD |
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-106220508-B | It reduces the acidity of cetane number improver and removes organic and inorganic impurity method | 北京兴有化工有限责任公司 | 2018-07-31 | — | — | CN | claimed |