Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 17/20 | 0.52 |
| ▸ | CTSL | P07711 | 4/20 | 0.51 |
| ▸ | CTSB | P07858 | 4/20 | 0.51 |
| ▸ | WNT3 | P56703 | 1/20 | 0.46 |
| ▸ | SFRP1 | Q8N474 | 1/20 | 0.46 |
| ▸ | CTSK | P43235 | 3/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3066945 | 1.00 | CTSS (0.52) | CTSSCTSLCTSBWNT3SFRP1 | |
| SCHEMBL3055891 | 0.90 | CTSS (0.50) | CTSSCTSLCTSBCTSK | |
| SCHEMBL3060642 | 0.84 | CTSS (0.55) | CTSSCTSLCTSBCTSK | |
| SCHEMBL3719140 | 0.84 | CTSS (0.55) | CTSSCTSLCTSBCTSK | |
| SCHEMBL3065895 | 0.84 | CTSS (0.67) | CTSSCTSLCTSB | |
| SCHEMBL3721404 | 0.84 | CTSS (0.55) | CTSSCTSLCTSBCTSK | |
| SCHEMBL3061232 | 0.84 | CTSS (0.55) | CTSSCTSLCTSBCTSK | |
| SCHEMBL3061623 | 0.84 | CTSS (0.52) | CTSSCTSLCTSBCTSK | |
| SCHEMBL3719266 | 0.84 | CTSS (0.52) | CTSSCTSLCTSBCTSK | |
| SCHEMBL695748 | 0.84 | CTSS (0.59) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010121918-A1 | PROLINE DERIVATIVES AS CATHEPSIN INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-10-28 | — | — | WO | disclosed |