Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 3/20 | 0.48 |
| ▸ | RIPK1 | Q13546 | 16/20 | 0.44 |
| ▸ | XIAP | P98170 | 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 | |
|---|---|---|---|---|
| SCHEMBL646096 | 0.86 | CASP1 (0.46) | CASP1 | |
| SCHEMBL5712919 | 0.86 | CASP1 (0.46) | CASP1 | |
| SCHEMBL646460 | 0.84 | CASP1 (0.45) | CASP1XIAP | |
| SCHEMBL647010 | 0.82 | CASP1 (0.43) | CASP1XIAP | |
| SCHEMBL647046 | 0.79 | CASP1 (0.43) | CASP1XIAP | |
| SCHEMBL648576 | 0.79 | CASP1 (0.42) | CASP1RIPK1XIAP | |
| SCHEMBL5712969 | 0.78 | MME (0.55) | CASP1RIPK1XIAP | |
| SCHEMBL644969 | 0.77 | CASP1 (0.42) | CASP1XIAP | |
| SCHEMBL647287 | 0.73 | CASP1 (0.43) | CASP1XIAP | |
| SCHEMBL5713036 | 0.71 | MME (0.49) | CASP1RIPK1XIAP |
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-0942925-B1 | INHIBITORS OF INTERLEUKIN-1 BETA CONVERTING ENZYME | VERTEX PHARMA (US) | 2006-11-22 | — | — | EP | disclosed |
| EP-1466921-A1 | Inhibitors of interleukin-1 beta converting enzyme | Vertex Pharmaceuticals Incorporated (US) | 2004-10-13 | — | — | EP | disclosed |