Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 6/20 | 0.40 |
| ▸ | CTSS | P25774 | 5/20 | 0.40 |
| ▸ | SYK | P43405 | 9/20 | 0.35 |
| ▸ | CTSK | P43235 | 2/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | GCK | P35557 | 3/20 | 0.32 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7012870 | 0.88 | CTSS (0.41) | CTSLCTSSCTSKCTSB | |
| SCHEMBL5360995 | 0.79 | CTSS (0.52) | CTSLCTSSSYKCTSKCTSB | |
| SCHEMBL14383695 | 0.79 | CTSS (0.52) | CTSLCTSSSYKCTSKCTSB | |
| SCHEMBL5363187 | 0.74 | CTSS (0.39) | CTSLCTSSCTSKCTSB | |
| SCHEMBL7417521 | 0.73 | CTSS (0.38) | CTSLCTSSCTSKCTSB | |
| SCHEMBL7422882 | 0.73 | CTSS (0.38) | CTSLCTSSCTSKCTSB | |
| SCHEMBL7007584 | 0.71 | CTSL (0.51) | CTSLCTSSCTSKCTSB | |
| SCHEMBL7007715 | 0.70 | CTSS (0.39) | CTSLCTSSCTSKCTSB | |
| SCHEMBL7004000 | 0.70 | CTSS (0.50) | CTSLCTSSCTSKCTSB | |
| SCHEMBL7417783 | 0.69 | CTSS (0.42) | CTSLCTSSCTSKCTSB |
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 |