Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 14/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 6/20 | 0.40 |
| ▸ | CTSB | P07858 | 11/20 | 0.39 |
| ▸ | CTSS | P25774 | 11/20 | 0.39 |
| ▸ | CTSK | P43235 | 11/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2104026 | 0.82 | CTSL (0.67) | CTSLCTSBCTSS | |
| SCHEMBL2104031 | 0.82 | CTSL (0.67) | CTSLCTSBCTSS | |
| SCHEMBL696209 | 0.72 | CTSS (0.56) | CTSLCTSBCTSSCTSK | |
| SCHEMBL2105921 | 0.67 | CTSL (0.82) | CTSLCTSBCTSS | |
| SCHEMBL14949911 | 0.66 | CTSS (0.56) | CTSLCTSBCTSSCTSK | |
| SCHEMBL14949907 | 0.64 | CTSS (0.60) | CTSS | |
| SCHEMBL15202523 | 0.64 | STS (0.44) | CTSLHSD11B1CTSBCTSSCTSK | |
| SCHEMBL696656 | 0.63 | CTSS (0.40) | CTSLCTSBCTSS | |
| SCHEMBL14977141 | 0.63 | CTSL (0.73) | CTSLCTSBCTSSCTSK | |
| SCHEMBL3079583 | 0.63 | CTSL (0.73) | CTSLCTSBCTSSCTSK |
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 |