Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 15/20 | 0.58 |
| ▸ | CASP3 | P42574 | 1/20 | 0.49 |
| ▸ | MME | P08473 | 1/20 | 0.48 |
| ▸ | ECE1 | P42892 | 1/20 | 0.48 |
| ▸ | PPARA | Q07869 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6801504 | 0.85 | CASP1 (0.60) | CASP1CASP3MMEECE1 | |
| SCHEMBL376886 | 0.83 | CASP1 (0.67) | CASP1MMEECE1PPARA | |
| SCHEMBL613386 | 0.83 | CASP1 (0.67) | CASP1MMEECE1PPARA | |
| SCHEMBL554032 | 0.83 | CASP1 (0.67) | CASP1MMEECE1PPARA | |
| SCHEMBL9069237 | 0.82 | CASP1 (0.60) | CASP1MMEECE1ALDH1A1 | |
| SCHEMBL6281724 | 0.80 | CASP1 (0.59) | CASP1CASP3MMEECE1MEN1 | |
| SCHEMBL6797428 | 0.80 | CASP1 (0.65) | CASP1CASP3MMEECE1PPARA | |
| SCHEMBL6801541 | 0.80 | CASP1 (0.59) | CASP1CASP3MMEECE1MEN1 | |
| SCHEMBL10605640 | 0.79 | PPARA (0.62) | CASP1MMEECE1PPARA | |
| SCHEMBL10789378 | 0.79 | MME (0.62) | CASP1CASP3MMEECE1HTT |
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-0623592-B1 | Peptide analogs as irreversible interleukin-1beta protease inhibitors | VERTEX PHARMA (US) | 2001-06-27 | — | — | EP | disclosed |
| EP-0623592-A1 | Peptide analogs as irreversible interleukin-1beta protease inhibitors | STERLING WINTHROP INC. (US) | 1994-11-09 | — | — | EP | disclosed |