Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 10/20 | 0.70 |
| ▸ | CA1 | P00915 | 10/20 | 0.70 |
| ▸ | CA2 | P00918 | 10/20 | 0.70 |
| ▸ | CA7 | P43166 | 10/20 | 0.70 |
| ▸ | CA9 | Q16790 | 10/20 | 0.70 |
| ▸ | CA14 | Q9ULX7 | 10/20 | 0.70 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.43 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.43 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12470240 | 0.84 | CA12 (0.62) | CA12CA1CA2CA7CA9 | |
| SCHEMBL5899097 | 0.84 | CA12 (0.77) | CA12CA1CA2CA7CA9 | |
| Isopropyl 4-Hydroxybenzoate SCHEMBL30846531 | 0.84 | CA12 (0.64) | CA12CA1CA2CA7CA9 | |
| SCHEMBL28360956 | 0.83 | CA12 (0.57) | CA12CA1CA2CA7CA9 | |
| SCHEMBL26983171 | 0.82 | CA12 (1.00) | CA12CA1CA2CA7CA9 | |
| SCHEMBL6781249 | 0.82 | CA12 (0.49) | CA12CA1CA2CA7CA9 | |
| SCHEMBL4817616 | 0.80 | CA12 (0.66) | CA12CA1CA2CA7CA9 | |
| SCHEMBL10549564 | 0.80 | CES2 (0.54) | CA12CA1CA2CA7CA9 | |
| SCHEMBL40169 | 0.79 | CA12 (1.00) | CA12CA1CA2CA7CA9 | |
| SCHEMBL31498357 | 0.79 | CA12 (1.00) | CA12CA1CA2CA7CA9 |
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-112649528-A | Food preservative content safety detection method | 安徽中青检验检测有限公司 | 2021-04-13 | — | — | CN | claimed |
| CN-112649528-A | Food preservative content safety detection method | 安徽中青检验检测有限公司 | 2021-04-13 | — | — | CN | disclosed |
| WO-1999011276-A1 | MEDICAMENT INCLUDING POTASSIUM IODIDE AND AMMONIUM CHLORIDE | HOOPER OSWALD EDMONDS (NZ) | 1999-03-11 | — | — | WO | disclosed |