Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA5A | P35218 | 2/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | NT5E | P21589 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL895305 | 0.87 | — | — | |
| Sulfuric Acid SCHEMBL28843562 | 0.83 | CA5A (0.50) | CA5ACA5BTSHRTDP1ALDH1A1 | |
| Vinylsulfonic Acid SCHEMBL28232842 | 0.80 | TDP1 (0.36) | CA5ACA5BTSHRTDP1ALDH1A1 | |
| Formaldehyde SCHEMBL27906837 | 0.77 | CA5A (0.50) | CA5ACA5BTSHRTDP1ALDH1A1 | |
| SCHEMBL56669 | 0.76 | — | — | |
| SCHEMBL15349524 | 0.76 | CA5A (0.62) | CA5ACA5BTSHRTDP1ALDH1A1 | |
| Butadiene SCHEMBL6048388 | 0.74 | CA2 (0.39) | CA5ACA5BTSHRTDP1CA2 | |
| Butadiene SCHEMBL11152037 | 0.74 | CA2 (0.67) | CA5ACA5BTSHRTDP1CA2 | |
| Butadiene SCHEMBL11152035 | 0.74 | CA2 (0.39) | CA5ACA5BTSHRTDP1CA2 | |
| Trifluoromethanesulfonic Acid SCHEMBL7781126 | 0.72 | ALDH1A1 (0.39) | TSHRTDP1ALDH1A1CA1CA2 |
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-115504961-A | Ester dithiocarbonate compound, electrolyte, preparation method of ester dithiocarbonate compound, preparation method of electrolyte and electrochemical device | 厦门海辰储能科技股份有限公司 | 2022-12-23 | — | — | CN | disclosed |