Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 4/20 | 0.62 |
| ▸ | CASP1 | P29466 | 1/20 | 0.56 |
| ▸ | CASP4 | P49662 | 1/20 | 0.56 |
| ▸ | CASP7 | P55210 | 1/20 | 0.56 |
| ▸ | CASP9 | P55211 | 1/20 | 0.56 |
| ▸ | CASP6 | P55212 | 1/20 | 0.56 |
| ▸ | TTR | P02766 | 1/20 | 0.55 |
| ▸ | CES1 | P23141 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | ALDH2 | P05091 | 3/20 | 0.53 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.53 |
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.52 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | TSPO | P30536 | 1/20 | 0.48 |
| ▸ | CA4 | P22748 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | S100A4 | P26447 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8296661 | 1.00 | CASP3 (0.62) | CASP3CASP1CASP4CASP7CASP9 | |
| SCHEMBL31536334 | 0.85 | CES1 (0.55) | CASP3CASP1CASP4CASP7CASP9 | |
| SCHEMBL7780180 | 0.85 | CES1 (0.55) | CASP3CASP1CASP4CASP7CASP9 | |
| SCHEMBL13113759 | 0.79 | CA2 (0.58) | CASP3TTRCA1CA2LMNA | |
| SCHEMBL29403414 | 0.78 | CASP3 (0.65) | CASP3CASP1CASP4CASP7CASP9 | |
| SCHEMBL9029012 | 0.78 | CASP3 (0.65) | CASP3CASP1CASP4CASP7CASP9 | |
| SCHEMBL16048101 | 0.78 | ALDH3A1 (0.65) | ALDH1A1ALDH2ALDH3A1CA1CA2 | |
| SCHEMBL21999394 | 0.78 | CA2 (0.64) | CASP3TTRCA1CA2LMNA | |
| SCHEMBL28581855 | 0.78 | CA2 (0.44) | CASP3ALDH1A1ALDH2ALDH3A1CA1 | |
| SCHEMBL3005504 | 0.77 | CASP3 (0.62) | CASP3CASP1CASP4CASP7CASP9 |
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-117088890-A | Pyrrolidone-containing pyrrolidine spiro bisoxindole compound as well as preparation method and application thereof | 江苏大学 | 2023-11-21 | — | — | CN | disclosed |