Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 19/20 | 0.79 |
| ▸ | CTSB | P07858 | 3/20 | 0.48 |
| ▸ | CTSL | P07711 | 2/20 | 0.48 |
| ▸ | CTSS | P25774 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4987845 | 1.00 | CTSK (0.79) | CTSKCTSBCTSLCTSS | |
| SCHEMBL4988348 | 0.91 | CTSK (0.79) | CTSKCTSBCTSLCTSS | |
| SCHEMBL4993036 | 0.91 | CTSK (0.79) | CTSKCTSBCTSLCTSS | |
| SCHEMBL4987639 | 0.90 | CTSK (0.77) | CTSKCTSBCTSLCTSS | |
| SCHEMBL5688506 | 0.90 | CTSK (0.77) | CTSKCTSBCTSLCTSS | |
| SCHEMBL4987665 | 0.90 | CTSK (0.77) | CTSKCTSBCTSLCTSS | |
| SCHEMBL4988743 | 0.89 | CTSK (0.76) | CTSKCTSBCTSLCTSS | |
| SCHEMBL1375902 | 0.89 | CTSK (0.76) | CTSKCTSBCTSLCTSS | |
| SCHEMBL4984718 | 0.89 | CTSK (0.76) | CTSKCTSBCTSLCTSS | |
| SCHEMBL4984939 | 0.89 | CTSK (0.76) | CTSKCTSBCTSLCTSS |
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-1644326-A1 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | Merck Frosst Canada Ltd. (CA) | 2006-04-12 | — | — | EP | disclosed |
| WO-2005000800-A1 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK FROSST CANADA LTD. (CA) | 2005-01-06 | — | — | WO | disclosed |