Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 16/20 | 0.40 |
| ▸ | CTSL | P07711 | 14/20 | 0.40 |
| ▸ | CTSB | P07858 | 2/20 | 0.40 |
| ▸ | CTSK | P43235 | 2/20 | 0.40 |
| ▸ | RORC | P51449 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL694745 | 0.84 | CTSS (0.46) | CTSSCTSLCTSBCTSKRORC | |
| SCHEMBL3061355 | 0.83 | CTSS (0.47) | CTSSCTSLCTSBCTSKRORC | |
| SCHEMBL3064422 | 0.83 | CTSS (0.47) | CTSSCTSLCTSBCTSKRORC | |
| SCHEMBL695526 | 0.74 | CTSS (0.59) | CTSSCTSLCTSK | |
| SCHEMBL1139337 | 0.71 | CTSS (0.50) | CTSSCTSLCTSBCTSKRORC | |
| SCHEMBL1140147 | 0.71 | CTSS (0.50) | CTSSCTSLCTSBCTSKRORC | |
| SCHEMBL1139340 | 0.71 | CTSS (0.50) | CTSSCTSLCTSBCTSKRORC | |
| SCHEMBL3066389 | 0.70 | CTSS (0.46) | CTSSCTSLCTSBCTSK | |
| SCHEMBL3066400 | 0.70 | CTSS (0.46) | CTSSCTSLCTSBCTSK | |
| SCHEMBL15327293 | 0.68 | CTSS (0.54) | CTSSCTSL |
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-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 |