Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 15/20 | 0.56 |
| ▸ | IL1B | P01584 | 4/20 | 0.55 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7443313 | 0.92 | CASP1 (0.59) | CASP1IL1BCAPN1 | |
| SCHEMBL7284663 | 0.92 | CASP1 (0.51) | CASP1IL1BCASP3 | |
| SCHEMBL623362 | 0.85 | CTSB (0.58) | CASP1IL1BCAPN1 | |
| SCHEMBL7283427 | 0.84 | CASP1 (0.52) | CASP1IL1BCASP3 | |
| SCHEMBL7277266 | 0.83 | CASP1 (0.64) | CASP1CASP3 | |
| SCHEMBL7429142 | 0.83 | CASP1 (0.57) | CASP1IL1BCAPN1 | |
| SCHEMBL7431065 | 0.82 | CASP1 (0.63) | CASP1IL1B | |
| SCHEMBL13951156 | 0.82 | CASP1 (0.52) | CASP1CASP3 | |
| SCHEMBL13928412 | 0.82 | CASP1 (0.52) | CASP1CASP3 | |
| SCHEMBL13018398 | 0.82 | CASP1 (0.52) | CASP1CASP3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0519748-B1 | Peptidyl derivatives as inhibitors of interleukin-1B converting enzyme | MERCK & CO INC (US) | 1998-09-02 | — | — | EP | disclosed |
| US-5434248-A | Peptidyl derivatives as inhibitors of interleukin-1β converting enzyme | MERCK & CO., INC. (US) | 1995-07-18 | — | — | US | disclosed |
| EP-0519748-A2 | Peptidyl derivatives as inhibitors of interleukin-1B converting enzyme | MERCK & CO. INC. (US) | 1992-12-23 | — | — | EP | disclosed |