Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK5 | Q9Y337 | 3/20 | 0.47 |
| ▸ | KLK7 | P49862 | 2/20 | 0.47 |
| ▸ | CASP1 | P29466 | 3/20 | 0.46 |
| ▸ | CASP3 | P42574 | 3/20 | 0.46 |
| ▸ | CASP7 | P55210 | 3/20 | 0.46 |
| ▸ | CASP6 | P55212 | 3/20 | 0.46 |
| ▸ | CASP8 | Q14790 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 4/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL948900 | 0.93 | KLK5 (0.51) | KLK5KLK7CASP1CASP3CASP7 | |
| SCHEMBL13197116 | 0.93 | KLK5 (0.51) | KLK5KLK7CASP1CASP3CASP7 | |
| SCHEMBL8721796 | 0.93 | KLK5 (0.51) | KLK5KLK7CASP1CASP3CASP7 | |
| SCHEMBL7283399 | 0.86 | CASP1 (0.47) | CASP1CASP3CASP7CASP6CASP8 | |
| SCHEMBL7287174 | 0.83 | CASP1 (0.44) | CASP1CASP3CASP7CASP6CASP8 | |
| SCHEMBL948901 | 0.80 | KLK5 (0.43) | KLK5KLK7CASP1CASP3CASP7 | |
| SCHEMBL13928447 | 0.80 | CMA1 (0.56) | — | |
| SCHEMBL12914558 | 0.79 | CASP3 (0.48) | CASP1CASP3CASP7CASP6CASP8 | |
| SCHEMBL8763134 | 0.79 | CASP1 (0.47) | CASP1CASP3CASP7CASP6CASP8 | |
| SCHEMBL14582931 | 0.77 | CASP3 (0.48) | KLK5KLK7CASP1CASP3CASP7 |
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 |