Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 5/20 | 0.46 |
| ▸ | CTSL | P07711 | 16/20 | 0.45 |
| ▸ | CTSB | P07858 | 14/20 | 0.45 |
| ▸ | CTSS | P25774 | 12/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6252796 | 1.00 | CTSK (0.46) | CTSKCTSLCTSBCTSS | |
| SCHEMBL6184610 | 1.00 | CTSK (0.46) | CTSKCTSLCTSBCTSS | |
| SCHEMBL6137090 | 0.82 | CTSL (0.49) | CTSKCTSLCTSBCTSS | |
| SCHEMBL4652077 | 0.79 | CTSK (0.48) | CTSKCTSLCTSBCTSS | |
| SCHEMBL6252182 | 0.79 | CTSK (0.48) | CTSKCTSLCTSBCTSS | |
| SCHEMBL10447393 | 0.78 | MME (0.34) | — | |
| SCHEMBL29050666 | 0.78 | ALDH1A1 (0.34) | — | |
| SCHEMBL7488897 | 0.75 | CTSK (0.48) | CTSKCTSLCTSBCTSS | |
| SCHEMBL6754233 | 0.74 | MME (0.30) | — | |
| SCHEMBL7957356 | 0.74 | SMN1; SMN2 (0.41) | — |
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-1569954-A1 | CYANOMETHYL DERIVATIVES AS CYSTEINE PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2005-09-07 | — | — | EP | disclosed |
| WO-2004052921-A1 | CYANOMETHYL DERIVATIVES AS CYSTEINE PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2004-06-24 | — | — | WO | disclosed |