Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP1 | P11387 | 4/20 | 0.42 |
| ▸ | CYCS | P99999 | 4/20 | 0.42 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.36 |
| ▸ | TERT | O14746 | 3/20 | 0.36 |
| ▸ | RARB | P10826 | 2/20 | 0.36 |
| ▸ | LTB4R | Q15722 | 2/20 | 0.35 |
| ▸ | PPARA | Q07869 | 2/20 | 0.34 |
| ▸ | PTGES | O14684 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | PPARD | Q03181 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28667782 | 0.89 | TOP1 (0.42) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL28675056 | 0.84 | TOP1 (0.47) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL28930641 | 0.83 | TERT (0.44) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL28667156 | 0.83 | TERT (0.44) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL28671162 | 0.80 | TERT (0.43) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL28672573 | 0.79 | CYCS (0.47) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL28680662 | 0.78 | CYCS (0.44) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL28665759 | 0.77 | ABCG2 (0.42) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL28665645 | 0.77 | TERT (0.44) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL28689712 | 0.77 | TERT (0.40) | TOP1CYCSABCG2ENPP2TERT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113831351-A | Novel tetrapyrrole derivatives and application thereof | 上海先辉医药科技有限公司 | 2021-12-24 | — | — | CN | claimed |
| CN-113831351-A | Novel tetrapyrrole derivatives and application thereof | 上海先辉医药科技有限公司 | 2021-12-24 | — | — | CN | disclosed |