Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 19/20 | 0.42 |
| ▸ | CTSL | P07711 | 15/20 | 0.42 |
| ▸ | CTSB | P07858 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL695262 | 0.88 | CTSS (0.44) | CTSSCTSLCTSBCTSK | |
| SCHEMBL696596 | 0.87 | LGMN (0.33) | CTSSCTSLCTSBCTSK | |
| SCHEMBL697007 | 0.87 | CTSS (0.53) | CTSSCTSLCTSBCTSK | |
| SCHEMBL695622 | 0.85 | CTSS (0.37) | CTSSCTSLCTSBCTSK | |
| SCHEMBL696454 | 0.80 | CTSS (0.44) | CTSSCTSLCTSBCTSK | |
| SCHEMBL2104931 | 0.77 | CTSS (0.52) | CTSSCTSLCTSBCTSK | |
| SCHEMBL2105129 | 0.77 | CTSS (0.52) | CTSSCTSLCTSBCTSK | |
| SCHEMBL15170080 | 0.76 | CTSS (0.49) | CTSSCTSLCTSBCTSK | |
| SCHEMBL693779 | 0.75 | CTSL (0.36) | CTSSCTSLCTSBCTSK | |
| SCHEMBL3727566 | 0.73 | CTSS (0.37) | CTSSCTSLCTSBCTSK |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2421826-A1 | PROLINE DERIVATIVES AS CATHEPSIN INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2012-02-29 | — | — | EP | claimed |
| WO-2010121918-A1 | PROLINE DERIVATIVES AS CATHEPSIN INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-10-28 | — | — | WO | claimed |
| EP-2421826-A1 | PROLINE DERIVATIVES AS CATHEPSIN INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2012-02-29 | — | — | EP | disclosed |
| WO-2010121918-A1 | PROLINE DERIVATIVES AS CATHEPSIN INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-10-28 | — | — | WO | disclosed |