Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 1.00 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 1.00 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.60 |
| ▸ | TSHR | P16473 | 3/20 | 0.60 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.31 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.31 |
| ▸ | LCK | P06239 | 1/20 | 0.31 |
| ▸ | FYN | P06241 | 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 | |
|---|---|---|---|---|
| SCHEMBL24573 | 1.00 | — | — | |
| Methyl Alcohol SCHEMBL2833259 | 0.97 | — | — | |
| Acetone SCHEMBL7194632 | 0.97 | TDP1 (0.93) | TDP1HSD17B10ALDH1A1TSHRLMNA | |
| Methane SCHEMBL28994664 | 0.97 | — | — | |
| Water SCHEMBL28846980 | 0.97 | — | — | |
| SCHEMBL28146932 | 0.97 | — | — | |
| Acetic Acid SCHEMBL27678300 | 0.94 | TDP1 (0.88) | TDP1HSD17B10ALDH1A1TSHRLMNA | |
| Acetic Acid SCHEMBL5680452 | 0.91 | TDP1 (0.82) | TDP1HSD17B10ALDH1A1TSHRFFAR3 | |
| Benzene SCHEMBL11792513 | 0.91 | HSD17B10 (0.82) | TDP1HSD17B10ALDH1A1TSHRLMNA | |
| Tetrachloroethylene SCHEMBL6393674 | 0.88 | TDP1 (0.78) | TDP1HSD17B10ALDH1A1TSHR |
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-108003268-A | A kind of unsaturation polyene alcohol ester | 王建华 | 2018-05-08 | — | — | CN | disclosed |
| CN-105777511-A | Energy-saving and efficient acetylacetone synthesis process | 衢州信步化工科技有限公司 | 2016-07-20 | — | — | CN | disclosed |