Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Methane SCHEMBL3831204 | 0.96 | CA12 (0.41) | CA12CA1CA2CA9TSHR | |
| SCHEMBL688868 | 0.96 | CA12 (0.41) | CA12CA1CA2CA9TSHR | |
| Methane SCHEMBL4837851 | 0.92 | CA12 (0.39) | CA12CA1CA2CA9TSHR | |
| Ammonia Solution, Strong SCHEMBL28393318 | 0.92 | CA12 (0.39) | CA12CA1CA2CA9TSHR | |
| Methane SCHEMBL2464824 | 0.92 | CA12 (0.39) | CA12CA1CA2CA9TSHR | |
| Water SCHEMBL4281166 | 0.92 | CA12 (0.39) | CA12CA1CA2CA9TSHR | |
| SCHEMBL451827 | 0.92 | CA12 (0.44) | CA12CA1CA2CA9TSHR | |
| SCHEMBL760725 | 0.92 | — | — | |
| SCHEMBL2486752 | 0.88 | CA12 (0.41) | CA12CA1CA2CA9TSHR | |
| SCHEMBL8858380 | 0.88 | CA12 (0.41) | CA12CA1CA2CA9TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114404861-A | Fly ash chelating agent and preparation method thereof | 江西鸿运环保科技有限公司 | 2022-04-29 | — | — | CN | claimed |
| CN-114404861-A | Fly ash chelating agent and preparation method thereof | 江西鸿运环保科技有限公司 | 2022-04-29 | — | — | CN | disclosed |
| CN-114404861-A | Fly ash chelating agent and preparation method thereof | 江西鸿运环保科技有限公司 | 2022-04-29 | — | — | CN | disclosed |