Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 4/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12531865 | 0.82 | PIK3CD (0.47) | PIK3CDCYP2D6SMN1; SMN2ALDH1A1CYP3A4 | |
| SCHEMBL24837312 | 0.79 | SMN1; SMN2 (0.31) | SMN1; SMN2 | |
| SCHEMBL23562819 | 0.75 | PIK3CD (0.41) | PIK3CDCYP2D6SMN1; SMN2ALDH1A1 | |
| SCHEMBL26400809 | 0.75 | CYP2D6 (0.47) | PIK3CDCYP2D6SMN1; SMN2ALDH1A1CYP3A4 | |
| SCHEMBL24008888 | 0.75 | SMN1; SMN2 (0.34) | SMN1; SMN2KDM4E | |
| SCHEMBL24837313 | 0.74 | KDM4E (0.32) | ALDH1A1KDM4E | |
| SCHEMBL24010072 | 0.73 | DRD2 (0.35) | SMN1; SMN2 | |
| SCHEMBL2001262 | 0.72 | — | — | |
| SCHEMBL20438377 | 0.72 | PIK3CD (0.61) | PIK3CDCYP2D6SMN1; SMN2 | |
| SCHEMBL24209746 | 0.72 | PIK3CD (0.61) | PIK3CDCYP2D6SMN1; SMN2 |
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-2023125989-A1 | QUINAZOLINE COMPOUND AND APPLICATION THEREOF | 上海医药集团股份有限公司 | 2023-07-06 | — | — | WO | disclosed |