Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 4/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 4/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA3 | P07451 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 2/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP12 | P39900 | 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 | |
|---|---|---|---|---|
| SCHEMBL18608233 | 0.81 | KCNH2 (0.51) | CYP2D6CYP2C19CYP3A4CYP2C9KCNH2 | |
| SCHEMBL12016065 | 0.79 | LMNA (0.46) | CYP2D6CYP2C19CYP3A4CYP2C9KCNH2 | |
| SCHEMBL17729351 | 0.79 | APP (0.53) | APPCYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL10488162 | 0.79 | CYP3A4 (0.41) | APPCYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL25864597 | 0.79 | CYP3A4 (0.41) | CYP2D6CYP2C19CYP3A4CYP2C9KCNH2 | |
| SCHEMBL8349426 | 0.78 | CYP2C19 (0.52) | APPCYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL19629593 | 0.78 | CYP2A6 (0.47) | CYP2D6CYP2C19CYP3A4CYP2C9KCNH2 | |
| SCHEMBL19036905 | 0.76 | GRM5 (0.43) | CYP2D6CYP2C19CYP3A4CYP2C9KCNH2 | |
| SCHEMBL26775741 | 0.76 | RARB (0.44) | APPCYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL7033211 | 0.76 | APP (0.48) | APPCYP2D6CYP2C19CYP3A4CYP2C9 |
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-116425607-A | Method for preparing cis-form or trans-form alkene by chromium-catalyzed intermediate alkyne selective hydrogenation | 四川大学 | 2023-07-14 | — | — | CN | disclosed |