Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 14/20 | 0.74 |
| ▸ | CTSS | P25774 | 14/20 | 0.58 |
| ▸ | CTSB | P07858 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL2105921 | 0.88 | CTSL (0.82) | CTSLCTSSCTSB | |
| SCHEMBL15327332 | 0.87 | CTSL (0.57) | CTSLCTSSCTSB | |
| SCHEMBL3078277 | 0.86 | CTSL (0.52) | CTSLCTSSCTSB | |
| SCHEMBL695397 | 0.85 | CTSL (1.00) | CTSLCTSSCTSB | |
| SCHEMBL695371 | 0.85 | CTSL (0.77) | CTSLCTSSCTSB | |
| SCHEMBL2104359 | 0.85 | CTSL (0.74) | CTSLCTSSCTSB | |
| SCHEMBL695566 | 0.82 | CTSL (0.91) | CTSLCTSSCTSB | |
| SCHEMBL694124 | 0.82 | CTSL (0.70) | CTSLCTSSCTSB | |
| SCHEMBL694062 | 0.82 | CTSL (0.93) | CTSLCTSSCTSB | |
| SCHEMBL695557 | 0.81 | CTSL (0.82) | CTSLCTSSCTSB |
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 5 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 |