Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 15/20 | 0.50 |
| ▸ | CTSL | P07711 | 8/20 | 0.39 |
| ▸ | CTSB | P07858 | 7/20 | 0.39 |
| ▸ | CTSK | P43235 | 5/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2104295 | 1.00 | CTSS (0.50) | CTSSCTSLCTSBCTSKTDP1 | |
| SCHEMBL699359 | 0.95 | CTSS (0.49) | CTSSCTSLCTSBCTSKTDP1 | |
| SCHEMBL694625 | 0.92 | CTSS (0.52) | CTSSCTSLCTSBCTSKAGTR2 | |
| SCHEMBL694626 | 0.92 | CTSS (0.52) | CTSSCTSLCTSBCTSKAGTR2 | |
| SCHEMBL694624 | 0.92 | CTSS (0.52) | CTSSCTSLCTSBCTSKAGTR2 | |
| SCHEMBL699930 | 0.92 | CTSS (0.43) | CTSSCTSLCTSBCTSKAGTR2 | |
| SCHEMBL695527 | 0.91 | CTSS (0.47) | CTSSCTSLCTSBCTSKAGTR2 | |
| SCHEMBL695854 | 0.90 | CTSS (0.43) | CTSSCTSLCTSBCTSK | |
| SCHEMBL695852 | 0.90 | CTSS (0.43) | CTSSCTSLCTSBCTSK | |
| SCHEMBL695853 | 0.90 | CTSS (0.43) | 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 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 |