Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21676796 | 0.90 | KDM4E (0.31) | KDM4EALDH1A1GAA | |
| SCHEMBL20908481 | 0.75 | ALDH1A1 (0.38) | KDM4EALDH1A1GAA | |
| SCHEMBL21676817 | 0.72 | PIK3CD (0.37) | KDM4EALDH1A1 | |
| SCHEMBL21676815 | 0.71 | DPP4 (0.31) | — | |
| SCHEMBL9924115 | 0.69 | ALDH1A1 (0.41) | KDM4EALDH1A1GAA | |
| SCHEMBL9924116 | 0.69 | ALDH1A1 (0.41) | KDM4EALDH1A1GAA | |
| SCHEMBL4569249 | 0.69 | ALDH1A1 (0.41) | KDM4EALDH1A1GAA | |
| SCHEMBL21676805 | 0.69 | — | — | |
| SCHEMBL25588742 | 0.68 | ALDH1A1 (0.40) | KDM4EALDH1A1GAA | |
| SCHEMBL20243860 | 0.66 | ALDH1A1 (0.36) | KDM4EALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020025030-A1 | PREPARATION AND APPLICATION OF AROMATIC COMPOUND HAVING IMMUNOREGULATORY FUNCTION | 上海轶诺药业有限公司 | 2020-02-06 | — | — | WO | disclosed |