Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 2/20 | 0.38 |
| ▸ | PHGDH | O43175 | 1/20 | 0.33 |
| ▸ | PDE9A | O76083 | 1/20 | 0.32 |
| ▸ | IDH1 | O75874 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 4/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | KIT | P10721 | 1/20 | 0.32 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.31 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.31 |
| ▸ | MTOR | P42345 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30998785 | 0.85 | SMN1; SMN2 (0.62) | SMN1; SMN2HTTCYP3A4CYP2B6 | |
| SCHEMBL30998829 | 0.83 | HTT (0.43) | SMN1; SMN2HTTCYP3A4CYP2B6 | |
| SCHEMBL30998814 | 0.82 | SMN1; SMN2 (0.44) | SMN1; SMN2HTTCYP3A4CYP2B6EGFR | |
| SCHEMBL30998844 | 0.77 | KMT2A (0.48) | SMN1; SMN2HTTCYP3A4CYP2B6EGFR | |
| SCHEMBL16321199 | 0.75 | SMN1; SMN2 (0.63) | SMN1; SMN2HTTCYP3A4CYP2B6EGFR | |
| SCHEMBL16321200 | 0.75 | SMN1; SMN2 (0.63) | SMN1; SMN2HTTCYP3A4CYP2B6EGFR | |
| SCHEMBL16322793 | 0.73 | SMN1; SMN2 (0.71) | SMN1; SMN2HTTCYP3A4CYP2B6CNR2 | |
| SCHEMBL16322795 | 0.73 | SMN1; SMN2 (0.71) | SMN1; SMN2HTTCYP3A4CYP2B6CNR2 | |
| SCHEMBL16356128 | 0.72 | SMN1; SMN2 (0.58) | SMN1; SMN2HTTCYP3A4CYP2B6 | |
| SCHEMBL16322521 | 0.71 | SMN1; SMN2 (0.63) | SMN1; SMN2HTTCYP3A4CYP2B6PDE9A |
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-118373777-A | Pyrimidine diketone derivative and preparation method and application thereof | 河北科技大学 | 2024-07-23 | — | — | CN | disclosed |