Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | G6PD | P11413 | 1/20 | 0.44 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | FBP1 | P09467 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP8 | P22894 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29149685 | 0.92 | CTSK (0.55) | CTSKALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3379460 | 0.92 | CTSK (0.55) | CTSKALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL28585286 | 0.92 | CTSK (0.55) | CTSKALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL29149684 | 0.92 | CTSK (0.55) | CTSKALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL29169692 | 0.91 | CTSK (0.58) | CTSKALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9620558 | 0.91 | CTSK (0.58) | CTSKALDH1A1CYP3A4CYP2C9CYP2C19 | |
| Hydrogen Sulfide SCHEMBL27733594 | 0.91 | CTSK (0.54) | CTSKALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL11038225 | 0.86 | CTSK (0.75) | CTSKALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL11278701 | 0.82 | LMNA (0.44) | CTSKMEN1KMT2AG6PDTLR9 | |
| SCHEMBL27746457 | 0.81 | HTR2A (0.49) | CTSKFBP1CA1CA2MMP1 |
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-116969868-A | Synthesis method of allyl sulfonyl compound | 南通大学 | 2023-10-31 | — | — | CN | disclosed |