Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNMT1 | P26358 | 1/20 | 0.63 |
| ▸ | CA2 | P00918 | 4/20 | 0.48 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 4/20 | 0.43 |
| ▸ | CA12 | O43570 | 4/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | F2 | P00734 | 2/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.39 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.39 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28229835 | 0.90 | DNMT1 (0.81) | DNMT1CA2PLCG1CA12CA9 | |
| SCHEMBL31411267 | 0.77 | DNMT1 (0.63) | DNMT1CA2CA12CA9CA1 | |
| SCHEMBL3917191 | 0.77 | DNMT1 (1.00) | DNMT1CA2MMP2CA12CA9 | |
| SCHEMBL7531692 | 0.77 | DNMT1 (0.63) | DNMT1CA2MMP2CA1MMP1 | |
| SCHEMBL3238479 | 0.77 | DNMT1 (0.63) | DNMT1CA2MMP2CA12CA9 | |
| SCHEMBL11293341 | 0.77 | DNMT1 (0.63) | DNMT1CA2MMP2CA12CA9 | |
| SCHEMBL16882624 | 0.74 | CA2 (0.50) | CA2PLCG1MMP2CA12CA9 | |
| SCHEMBL15076023 | 0.74 | CA2 (0.50) | DNMT1CA2PLCG1MMP2CA12 | |
| SCHEMBL10396837 | 0.73 | CA2 (0.48) | CA2PLCG1MMP2CA12CA9 | |
| SCHEMBL7537258 | 0.72 | DNMT1 (0.62) | DNMT1CA2MMP2CA12CA9 |
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-114213298-B | Method for preparing thiosulfonate compound by directly oxidizing thiophenol | 南昌大学 | 2022-12-06 | — | — | CN | disclosed |
| CN-114213298-A | Method for preparing thiosulfonate compound by directly oxidizing thiophenol | 南昌大学 | 2022-03-22 | — | — | CN | disclosed |