Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.49 |
| ▸ | CA9 | Q16790 | 2/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HPRT1 | P00492 | 2/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.39 |
| ▸ | TUBB | P07437 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30998117 | 1.00 | CA1 (0.49) | CA1CA9CA2ALDH1A1HSD17B10 | |
| SCHEMBL15903702 | 0.85 | CA1 (0.52) | CA1CA9CA2ALDH1A1HSD17B10 | |
| SCHEMBL17318166 | 0.85 | CA1 (0.66) | CA1CA9CA2TDP1CYP2A6 | |
| SCHEMBL30290794 | 0.83 | CA1 (0.46) | CA1CA9CA2ALDH1A1HSD17B10 | |
| SCHEMBL29561407 | 0.82 | CA2 (0.49) | CA1CA9CA2ALDH1A1HSD17B10 | |
| SCHEMBL28069382 | 0.82 | CA2 (0.73) | CA1CA9CA2ALDH1A1HSD17B10 | |
| SCHEMBL15903703 | 0.82 | GAA (0.49) | CA1CA9CA2ALDH1A1HSD17B10 | |
| SCHEMBL18346485 | 0.81 | ALDH1A1 (0.36) | CA1CA9CA2ALDH1A1HSD17B10 | |
| SCHEMBL17233556 | 0.80 | CA2 (0.52) | CA1CA9CA2TDP1CYP2A6 | |
| SCHEMBL12465666 | 0.80 | HPRT1 (0.44) | CA1CA9CA2ALDH1A1HSD17B10 |
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-111689929-B | Sulfur fluoride (VI) compound and preparation method thereof | 斯克里普斯研究所 | 2024-05-31 | — | — | CN | disclosed |