Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 16/20 | 0.57 |
| ▸ | IL1B | P01584 | 4/20 | 0.57 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12450466 | 0.80 | CASP1 (0.61) | CASP1IL1B | |
| SCHEMBL12450458 | 0.80 | CASP1 (0.71) | CASP1IL1BELANE | |
| SCHEMBL951210 | 0.79 | CASP1 (0.73) | CASP1IL1BELANE | |
| SCHEMBL645752 | 0.73 | CASP1 (0.62) | CASP1IL1B | |
| SCHEMBL12914456 | 0.73 | CASP1 (0.62) | CASP1IL1B | |
| SCHEMBL4459947 | 0.73 | CASP1 (1.00) | CASP1IL1BELANE | |
| SCHEMBL12450638 | 0.73 | CASP1 (1.00) | CASP1IL1BELANE | |
| SCHEMBL950212 | 0.73 | CASP1 (0.61) | CASP1IL1BELANE | |
| SCHEMBL12450470 | 0.73 | CASP1 (0.61) | CASP1IL1BELANE | |
| SCHEMBL949357 | 0.71 | CASP1 (0.60) | CASP1IL1BELANE |
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 |
|---|---|---|---|---|---|---|---|
| EP-2123665-A2 | Inhibitors of interleukin-1Beta converting enzyme | Vertex Pharmaceuticals Incorporated (US) | 2009-11-25 | — | — | EP | disclosed |