Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 15/20 | 0.45 |
| ▸ | CTSL | P07711 | 9/20 | 0.44 |
| ▸ | CTSK | P43235 | 3/20 | 0.41 |
| ▸ | CTSB | P07858 | 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 | |
|---|---|---|---|---|
| SCHEMBL5364179 | 1.00 | CTSS (0.45) | CTSSCTSLCTSKCTSB | |
| SCHEMBL5364173 | 1.00 | CTSS (0.45) | CTSSCTSLCTSKCTSB | |
| SCHEMBL5364077 | 0.93 | CTSS (0.52) | CTSSCTSLCTSKCTSB | |
| SCHEMBL5364090 | 0.93 | CTSS (0.52) | CTSSCTSLCTSKCTSB | |
| SCHEMBL14383664 | 0.90 | CTSS (0.47) | CTSSCTSLCTSKCTSB | |
| SCHEMBL6764800 | 0.89 | CTSS (0.46) | CTSSCTSLCTSKCTSB | |
| SCHEMBL6764797 | 0.89 | CTSS (0.46) | CTSSCTSLCTSKCTSB | |
| SCHEMBL14383662 | 0.87 | CTSS (0.62) | CTSSCTSL | |
| SCHEMBL6108168 | 0.87 | CTSS (0.42) | CTSSCTSLCTSK | |
| SCHEMBL6108160 | 0.87 | CTSS (0.42) | CTSSCTSLCTSK |
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-1322613-A1 | SPIROHETEROCYCLIC NITRILES USEFUL AS REVERSIBLE INHIBITORS OF CYSTEINE PROTEASES | BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) | 2003-07-02 | — | — | EP | disclosed |
| WO-2002020485-A1 | SPIROHETEROCYCLIC NITRILES USEFUL AS REVERSIBLE INHIBITORS OF CYSTEINE PROTEASES | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2002-03-14 | — | — | WO | disclosed |