Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 16/20 | 0.89 |
| ▸ | CTSB | P07858 | 1/20 | 0.46 |
| ▸ | CTSS | P25774 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17008371 | 1.00 | CTSK (0.89) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL17020278 | 0.94 | CTSK (1.00) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL17008375 | 0.94 | CTSK (1.00) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL17008385 | 0.94 | CTSK (1.00) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL17008687 | 0.94 | CTSK (0.79) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL18858018 | 0.92 | CTSK (0.76) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL18279793 | 0.92 | CTSK (0.76) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL23968195 | 0.91 | CTSK (0.83) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL17008226 | 0.90 | CTSK (0.89) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL17008355 | 0.88 | CTSK (0.70) | CTSKCTSBCTSS |
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-2015120580-A1 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2015-08-20 | — | — | WO | claimed |