Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | GAA | P10253 | 5/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | APEX1 | P27695 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
| ▸ | TYK2 | P29597 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23879268 | 1.00 | ALDH1A1 (0.47) | ALDH1A1GAALMNAL3MBTL1APEX1 | |
| SCHEMBL30452538 | 0.88 | ALDH1A1 (0.51) | ALDH1A1GAALMNAL3MBTL1HPGD | |
| SCHEMBL23879255 | 0.88 | ALDH1A1 (0.51) | ALDH1A1GAALMNAL3MBTL1HPGD | |
| SCHEMBL30452496 | 0.83 | LMNA (0.37) | LMNAAPEX1HPGDJAK1TYK2 | |
| SCHEMBL23879282 | 0.83 | LMNA (0.37) | LMNAAPEX1HPGDJAK1TYK2 | |
| SCHEMBL23894399 | 0.73 | HPGD (0.47) | LMNAAPEX1HPGDKMT2ADRD2 | |
| SCHEMBL7591249 | 0.73 | ALDH1A1 (0.57) | ALDH1A1GAALMNAL3MBTL1HPGD | |
| SCHEMBL23879248 | 0.72 | TAS1R3 (0.38) | ALDH1A1GAALMNAL3MBTL1HPGD | |
| SCHEMBL30452200 | 0.72 | TAS1R3 (0.38) | ALDH1A1GAALMNAL3MBTL1HPGD | |
| SCHEMBL28420887 | 0.71 | TAS1R3 (0.38) | ALDH1A1LMNAL3MBTL1HPGDKMT2A |
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-111253404-B | Nitrogen-containing heterocyclic compound and composition, preparation method and application thereof | 上海医药集团股份有限公司 | 2023-05-23 | — | — | CN | disclosed |