Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP1 | P11387 | 4/20 | 0.47 |
| ▸ | CYCS | P99999 | 4/20 | 0.46 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
| ▸ | TERT | O14746 | 3/20 | 0.37 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.37 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | RARB | P10826 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28683445 | 0.88 | TOP1 (0.47) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL28930641 | 0.86 | TERT (0.44) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL28667156 | 0.86 | TERT (0.44) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL28930627 | 0.84 | TOP1 (0.42) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL28671162 | 0.83 | TERT (0.43) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL29558419 | 0.82 | TOP1 (0.61) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL3794157 | 0.82 | TOP1 (0.61) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL28665645 | 0.82 | TERT (0.44) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL28672573 | 0.79 | CYCS (0.47) | TOP1CYCSABCG2ENPP2TERT | |
| SCHEMBL10730297 | 0.79 | MEN1 (0.57) | TOP1CYCSABCG2ENPP2MEN1 |
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 |