Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29694576 | 0.87 | ALDH1A1 (0.31) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL2804115 | 0.83 | CA12 (0.48) | CA12CA1CA2CA9 | |
| SCHEMBL29694574 | 0.76 | ALDH1A1 (0.40) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL8388878 | 0.76 | CA12 (0.45) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL29694579 | 0.75 | MEN1 (0.34) | CA12CA1CA2CA9 | |
| SCHEMBL11718559 | 0.70 | PKM (0.36) | CA12CA1CA2CA9ALDH1A1 | |
| Butyric Acid SCHEMBL2380332 | 0.70 | FFAR3 (0.42) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL28836119 | 0.70 | CA12 (0.37) | CA12CA1CA2CA9 | |
| SCHEMBL13979997 | 0.70 | CA12 (0.37) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL30454829 | 0.69 | CA12 (0.34) | CA12CA1CA2CA9ALDH1A1 |
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-116183761-A | Method for measuring content of allyl thiourethane | 重庆康普化学工业股份有限公司 | 2023-05-30 | — | — | CN | disclosed |