Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 14/20 | 0.47 |
| ▸ | CTSK | P43235 | 7/20 | 0.47 |
| ▸ | CTSL | P07711 | 9/20 | 0.46 |
| ▸ | CTSB | P07858 | 6/20 | 0.46 |
| ▸ | ACE | P12821 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5517774 | 0.90 | CTSS (0.60) | CTSSCTSKCTSLCTSB | |
| SCHEMBL5517769 | 0.90 | CTSS (0.60) | CTSSCTSKCTSLCTSB | |
| SCHEMBL5523222 | 0.89 | NPC1 (0.53) | CTSSCTSKCTSLCTSBPOLB | |
| SCHEMBL5532237 | 0.88 | CTSS (0.53) | CTSSCTSKCTSLCTSB | |
| SCHEMBL5518402 | 0.87 | ALDH1A1 (0.53) | CTSSCTSKCTSLPOLB | |
| SCHEMBL6742386 | 0.83 | CTSS (0.56) | CTSSCTSKCTSLCTSBACE | |
| SCHEMBL5524107 | 0.80 | CTSL (0.71) | CTSSCTSKCTSLCTSB | |
| SCHEMBL5524111 | 0.80 | CTSL (0.71) | CTSSCTSKCTSLCTSB | |
| SCHEMBL5526393 | 0.79 | CTSS (0.52) | CTSSCTSKCTSLCTSBACE | |
| SCHEMBL5526397 | 0.79 | CTSS (0.52) | CTSSCTSKCTSLCTSBACE |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1452522-A2 | Novel compounds and compositions as protease inhibitors | AXYS PHARMACEUTICALS, INC. (US) | 2004-09-01 | — | — | EP | disclosed |