Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 19/20 | 0.43 |
| ▸ | CASP1 | P29466 | 18/20 | 0.43 |
| ▸ | CASP7 | P55210 | 14/20 | 0.43 |
| ▸ | CASP6 | P55212 | 13/20 | 0.43 |
| ▸ | CASP8 | Q14790 | 12/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL14288639 | 0.84 | CASP3 (0.42) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL14288643 | 0.83 | CASP3 (0.43) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL8287670 | 0.71 | CASP1 (0.51) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL14288658 | 0.69 | CASP3 (0.45) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL14288660 | 0.69 | CASP3 (0.51) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL14288654 | 0.68 | CTSS (0.57) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL14288633 | 0.67 | CTSS (0.56) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL14288661 | 0.65 | CTSS (0.60) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL14288634 | 0.65 | CTSS (0.56) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL8289747 | 0.65 | CASP3 (0.47) | CASP3CASP1CASP7CASP6CASP8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005039496-A2 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2005-05-06 | — | — | WO | disclosed |