Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
| ▸ | CASP3 | P42574 | 1/20 | 0.30 |
| ▸ | CASP7 | P55210 | 1/20 | 0.30 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3873957 | 1.00 | CASP1 (0.30) | CASP1CASP3CASP7CASP8 | |
| SCHEMBL8293818 | 0.83 | CTSS (0.36) | — | |
| SCHEMBL3872209 | 0.82 | PI4KB (0.33) | CASP1CASP3CASP7CASP8 | |
| SCHEMBL3873891 | 0.82 | PI4KB (0.33) | CASP1CASP3CASP7CASP8 | |
| SCHEMBL3873948 | 0.77 | — | — | |
| SCHEMBL3871719 | 0.74 | SMN1; SMN2 (0.37) | — | |
| SCHEMBL3871991 | 0.73 | — | — | |
| SCHEMBL3884984 | 0.71 | — | — | |
| SCHEMBL3871077 | 0.71 | — | — | |
| SCHEMBL3873326 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7482448-B2 | Compounds and compositions as cathepsin inhibitors | AVENTIS PHARMACEUTICALS INC. (US) | 2009-01-27 | — | — | US | disclosed |