Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 16/20 | 0.44 |
| ▸ | CTSL | P07711 | 14/20 | 0.44 |
| ▸ | CTSB | P07858 | 3/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL695250 | 0.99 | CTSS (0.43) | CTSSCTSLCTSBCTSK | |
| SCHEMBL696447 | 0.91 | CTSS (0.49) | CTSSCTSLCTSB | |
| SCHEMBL696530 | 0.91 | CTSS (0.39) | CTSSCTSLCTSBCTSK | |
| Hydrochloric Acid SCHEMBL695707 | 0.90 | CTSS (0.39) | CTSSCTSLCTSBCTSK | |
| SCHEMBL697726 | 0.90 | CTSS (0.50) | CTSSCTSLCTSB | |
| Hydrochloric Acid SCHEMBL694103 | 0.89 | CTSS (0.49) | CTSSCTSLCTSB | |
| SCHEMBL15170080 | 0.89 | CTSS (0.49) | CTSSCTSLCTSBCTSK | |
| SCHEMBL699205 | 0.87 | CTSS (0.44) | CTSSCTSLCTSB | |
| SCHEMBL696291 | 0.86 | CTSS (0.42) | CTSSCTSLCTSB | |
| Hydrochloric Acid SCHEMBL695363 | 0.85 | CTSS (0.42) | CTSSCTSLCTSB |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8163793-B2 | Proline derivatives | HOFFMAN-LA ROCHE INC. (US) | 2012-04-24 | — | — | US | claimed |
| 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 |
| US-8163793-B2 | Proline derivatives | HOFFMAN-LA ROCHE INC. (US) | 2012-04-24 | — | — | US | disclosed |
| 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 |