Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 2/20 | 0.41 |
| ▸ | CASP8 | Q14790 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP9 | P55211 | 1/20 | 0.41 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29179591 | 1.00 | CASP3 (0.41) | CASP3CASP8CASP1CASP9CASP6 | |
| SCHEMBL24710762 | 1.00 | CASP3 (0.41) | CASP3CASP8CASP1CASP9CASP6 | |
| SCHEMBL24710107 | 0.83 | CASP3 (0.43) | CASP3CASP8CASP1CASP9CASP6 | |
| SCHEMBL24939430 | 0.82 | CASP3 (0.40) | CASP3CASP8CASP1CASP9CASP6 | |
| Hydrochloric Acid SCHEMBL30277121 | 0.81 | CASP3 (0.39) | CASP3CASP8CASP1CASP9CASP6 | |
| Hydrochloric Acid SCHEMBL29179573 | 0.81 | CASP3 (0.39) | CASP3CASP8CASP1CASP9CASP6 | |
| Hydrochloric Acid SCHEMBL29179565 | 0.81 | CASP3 (0.39) | CASP3CASP8CASP1CASP9CASP6 | |
| Hydrochloric Acid SCHEMBL29179568 | 0.81 | CASP3 (0.39) | CASP3CASP8CASP1CASP9CASP6 | |
| SCHEMBL29179671 | 0.81 | CTSB (0.45) | CASP3CASP8CASP6 | |
| SCHEMBL29179673 | 0.81 | CTSB (0.45) | CASP3CASP8CASP6 |
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 |