Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 19/20 | 0.50 |
| ▸ | CASP6 | P55212 | 19/20 | 0.50 |
| ▸ | CASP8 | Q14790 | 19/20 | 0.50 |
| ▸ | CASP7 | P55210 | 1/20 | 0.42 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.42 |
| ▸ | ITGA2B | P08514 | 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 | |
|---|---|---|---|---|
| SCHEMBL7419147 | 0.89 | CASP3 (0.45) | CASP3CASP6CASP8CASP7 | |
| SCHEMBL6831425 | 0.80 | CTSV (0.45) | CASP3CASP6CASP8CASP7 | |
| SCHEMBL7201965 | 0.79 | CASP3 (0.77) | CASP3CASP6CASP8CASP7 | |
| SCHEMBL7200874 | 0.70 | CASP3 (0.40) | CASP3CASP6CASP8CASP7 | |
| SCHEMBL5711363 | 0.70 | ALDH1A1 (0.56) | — | |
| SCHEMBL6446379 | 0.70 | ALDH1A1 (0.56) | — | |
| SCHEMBL7404706 | 0.66 | CASP3 (0.57) | CASP3CASP6CASP8CASP7 | |
| SCHEMBL12716161 | 0.66 | CASP3 (0.55) | CASP3CASP6CASP8CASP7 | |
| SCHEMBL25985226 | 0.66 | KDM4E (0.52) | CASP3CASP6CASP8CASP7 | |
| SCHEMBL12745894 | 0.66 | CASP3 (0.54) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1480999-A2 | (SUBSTITUTED)ACYL DIPEPTIDYL INHIBITORS OF THE ICE/CED-3 FAMILY OF CYSTEINE PROTEASES | Idun Pharmaceuticals (US) | 2004-12-01 | — | — | EP | disclosed |
| WO-2003072528-A2 | (SUBSTITUTED)ACYL DIPEPTIDYL INHIBITORS OF THE ICE/CED-3 FAMILY OF CYSTEINE PROTEASES | IDUN PHARMACEUTICALS, INC. (US) | 2003-09-04 | — | — | WO | disclosed |