Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | CA3 | P07451 | 1/20 | 0.48 |
| ▸ | CA4 | P22748 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | P4HB | P07237 | 1/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 3/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.38 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2000756 | 0.83 | HSD11B1 (0.46) | CA2TDP1HSD11B1IDO1KIF11 | |
| Lithium SCHEMBL5691154 | 0.81 | HSD11B1 (0.44) | CA2TDP1HSD11B1IDO1KIF11 | |
| Phenol SCHEMBL7497469 | 0.80 | TDP1 (0.50) | CA12CA1CA2GLACA3 | |
| SCHEMBL4891656 | 0.77 | HSD17B1 (0.41) | CA12CA1CA2CA3CA4 | |
| SCHEMBL7179699 | 0.77 | ALDH1A1 (0.45) | CA12CA2CA3CA4TDP1 | |
| SCHEMBL28336714 | 0.77 | ALDH1A1 (0.46) | TDP1HSD11B1MAOBIDO1KIF11 | |
| Phenol SCHEMBL28242955 | 0.77 | CA1 (0.46) | CA12CA1CA2GLACA3 | |
| SCHEMBL28075389 | 0.76 | HSD17B1 (0.40) | CA12CA1CA2CA3CA4 | |
| SCHEMBL28487551 | 0.75 | ALDH1A1 (0.44) | CA1CA2CA9TDP1HSD11B1 | |
| Phenol SCHEMBL28056367 | 0.73 | CA12 (0.69) | CA12CA1CA2GLACA3 |
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-104011083-B | Use the polymerization of the particle containing surfactant | 住友化学株式会社 | 2016-12-21 | — | — | CN | disclosed |