Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 3/20 | 0.45 |
| ▸ | CTSL | P07711 | 2/20 | 0.45 |
| ▸ | CTSS | P25774 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | CASP6 | P55212 | 1/20 | 0.42 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29179671 | 1.00 | CTSB (0.45) | CTSBCTSLCTSSCASP3CASP6 | |
| SCHEMBL24710113 | 0.87 | CASP3 (0.51) | CTSBCTSLCTSSCASP3CASP6 | |
| SCHEMBL30277064 | 0.87 | CASP3 (0.51) | CTSBCTSLCTSSCASP3CASP6 | |
| SCHEMBL29179619 | 0.86 | CASP3 (0.42) | CTSBCTSSCASP3CASP6CASP8 | |
| SCHEMBL29179617 | 0.86 | CASP3 (0.42) | CTSBCTSSCASP3CASP6CASP8 | |
| SCHEMBL25862533 | 0.82 | CTSL (0.57) | CTSBCTSLCTSS | |
| SCHEMBL29179618 | 0.82 | CTSL (0.57) | CTSBCTSLCTSS | |
| SCHEMBL25855508 | 0.82 | CTSL (0.57) | CTSBCTSLCTSS | |
| SCHEMBL29179591 | 0.81 | CASP3 (0.41) | CASP3CASP6CASP8 | |
| SCHEMBL29179587 | 0.81 | CASP3 (0.41) | CASP3CASP6CASP8 |
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-117794896-A | Protease inhibitors for the treatment of coronavirus infections | 斯克里普斯研究学院 | 2024-03-29 | — | — | CN | disclosed |