Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 2/20 | 0.41 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARD | Q03181 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 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 | |
|---|---|---|---|---|
| SCHEMBL28275335 | 0.90 | CA1 (0.45) | PTPN1AKR1B10AKR1B1APPMAPT | |
| SCHEMBL873591 | 0.83 | CA1 (0.40) | AKR1B10AKR1B1CA1CA2ALOX5 | |
| SCHEMBL7948327 | 0.83 | CA1 (0.53) | MAPTCA1CA2 | |
| Bicarbonate SCHEMBL28192811 | 0.81 | CA1 (0.38) | PTPN1AKR1B10AKR1B1CA1CA2 | |
| SCHEMBL5606507 | 0.80 | PPARG (0.48) | AKR1B10AKR1B1CA1CA2CA12 | |
| SCHEMBL28525105 | 0.80 | PTPN1 (0.42) | PTPN1APPMAPTALOX5 | |
| SCHEMBL27983290 | 0.78 | ALOX5 (0.47) | PTPN1ALOX5 | |
| SCHEMBL28922085 | 0.76 | PTGER3 (0.53) | CA1CA2CA4ALOX5 | |
| Benzyl Salicylate SCHEMBL27477497 | 0.74 | TDP1 (0.55) | CA12CA4CA6CA5ACA7 | |
| SCHEMBL7948311 | 0.74 | HNF4A (0.50) | PTPN1MAPT |
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-104974199-B | Isoacteoside derivative and its preparation method and application | 杏辉天力（杭州）药业有限公司 | 2020-12-25 | — | — | CN | disclosed |