Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | NQO2 | P16083 | 1/20 | 0.37 |
| ▸ | TDO2 | P48775 | 2/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | FLT1 | P17948 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.35 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.35 |
| ▸ | TNKS | O95271 | 1/20 | 0.35 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.35 |
| ▸ | PARP2 | Q9UGN5 | 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 | |
|---|---|---|---|---|
| SCHEMBL1634376 | 0.83 | ALDH1A1 (0.45) | ALDH1A1GAAKDM4ESMN1; SMN2NQO2 | |
| SCHEMBL30527150 | 0.81 | NQO2 (0.45) | ALDH1A1GAAKDM4ESMN1; SMN2NQO2 | |
| SCHEMBL25903679 | 0.81 | NQO2 (0.45) | ALDH1A1GAAKDM4ESMN1; SMN2NQO2 | |
| SCHEMBL1633186 | 0.80 | PDE4B (0.40) | ALDH1A1GAAKDM4ESMN1; SMN2NQO2 | |
| SCHEMBL3980812 | 0.78 | ALDH1A1 (0.44) | ALDH1A1GAAKDM4ESMN1; SMN2HTT | |
| SCHEMBL25328427 | 0.75 | KDM4E (0.47) | ALDH1A1KDM4ESMN1; SMN2TNKSTNKS2 | |
| SCHEMBL25328584 | 0.72 | ALDH1A1 (0.41) | ALDH1A1GAAKDM4ESMN1; SMN2HTT | |
| SCHEMBL558755 | 0.71 | ALDH1A1 (0.50) | ALDH1A1KDM4ESMN1; SMN2NQO2NPC1 | |
| SCHEMBL28840365 | 0.70 | ALDH1A1 (0.49) | ALDH1A1GAAKDM4ESMN1; SMN2HTT | |
| SCHEMBL18073575 | 0.70 | ALDH1A1 (0.53) | ALDH1A1GAAKDM4ESMN1; SMN2HTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023143135-A1 | QUINAZOLINE DERIVATIVE AND USE THEREOF | 赛诺哈勃药业（成都）有限公司 | 2023-08-03 | — | — | WO | disclosed |
| CN-116514728-A | Quinazoline derivative and application thereof | 赛诺哈勃药业（成都）有限公司 | 2023-08-01 | — | — | CN | disclosed |