Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 6/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 5/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | EPHA2 | P29317 | 3/20 | 0.44 |
| ▸ | SRC | P12931 | 4/20 | 0.43 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.43 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29713896 | 1.00 | PDE10A (0.47) | PDE10AEGFRCYP2C19KDRKDM4E | |
| SCHEMBL28798349 | 0.94 | PDE10A (0.50) | PDE10AEGFRKDRKDM4EEPHA2 | |
| SCHEMBL28798338 | 0.90 | EGFR (0.50) | PDE10AEGFRKDRKDM4EEPHA2 | |
| SCHEMBL29713888 | 0.90 | EGFR (0.50) | PDE10AEGFRKDRKDM4EEPHA2 | |
| SCHEMBL28798364 | 0.87 | EGFR (0.49) | PDE10AEGFRKDRKDM4EEPHA2 | |
| SCHEMBL29713885 | 0.87 | EGFR (0.49) | PDE10AEGFRKDRKDM4EEPHA2 | |
| SCHEMBL29713901 | 0.85 | EGFR (0.49) | PDE10AEGFRCYP2C19KDRKDM4E | |
| SCHEMBL28798381 | 0.85 | EGFR (0.49) | PDE10AEGFRCYP2C19KDRKDM4E | |
| SCHEMBL28798405 | 0.83 | PDE10A (0.47) | PDE10AEGFRKDRKDM4EEPHA2 | |
| SCHEMBL30090586 | 0.82 | CYP2C19 (0.46) | PDE10AEGFRCYP2C19KDRKDM4E |
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-114835683-A | Quinazoline-4, 6-diamine compound containing morpholinyl aromatic heterocycle and preparation method thereof | 江苏食品药品职业技术学院 | 2022-08-02 | — | — | CN | disclosed |