Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARK7 | Q99497 | 4/20 | 0.69 |
| ▸ | NSD2 | O96028 | 1/20 | 0.62 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.56 |
| ▸ | CES1 | P23141 | 2/20 | 0.53 |
| ▸ | CDC25A | P30304 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | ALDH3A1 | P30838 | 4/20 | 0.50 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28547202 | 1.00 | PARK7 (0.69) | PARK7NSD2CHRM5CES1CDC25A | |
| SCHEMBL28546572 | 1.00 | PARK7 (0.69) | PARK7NSD2CHRM5CES1CDC25A | |
| SCHEMBL28539851 | 1.00 | PARK7 (0.69) | PARK7NSD2CHRM5CES1CDC25A | |
| SCHEMBL28547209 | 0.98 | PARK7 (0.71) | PARK7NSD2CHRM5CES1CDC25A | |
| SCHEMBL3016200 | 0.93 | PARK7 (0.68) | PARK7NSD2CHRM5CES1CDC25A | |
| SCHEMBL28909405 | 0.91 | PARK7 (0.75) | PARK7NSD2CHRM5CES1ALDH1A1 | |
| SCHEMBL11149802 | 0.91 | PARK7 (0.62) | PARK7NSD2CHRM5CES1ALDH1A1 | |
| SCHEMBL11150483 | 0.89 | PARK7 (0.63) | PARK7NSD2CHRM5ALDH1A1ALDH3A1 | |
| SCHEMBL7833229 | 0.85 | PARK7 (0.67) | PARK7NSD2CHRM5ALDH1A1ALDH3A1 | |
| SCHEMBL28533382 | 0.84 | PARK7 (0.65) | PARK7NSD2CHRM5ALDH1A1ALDH3A1 |
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-112538041-A | Bimolecular indole-2, 3-dione derivative and application thereof | 浙江大学 | 2021-03-23 | — | — | CN | claimed |