Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 20/20 | 0.52 |
| ▸ | CTSB | P07858 | 11/20 | 0.38 |
| ▸ | CTSS | P25774 | 8/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16635725 | 0.88 | CTSK (0.60) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16635722 | 0.88 | CTSK (0.68) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16637706 | 0.87 | CTSK (0.35) | CTSK | |
| SCHEMBL16638095 | 0.85 | CTSK (0.35) | CTSK | |
| SCHEMBL16636270 | 0.80 | CTSK (0.54) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16636272 | 0.80 | CTSK (0.62) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16635936 | 0.80 | CTSK (0.62) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16635940 | 0.80 | CTSK (0.54) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16644746 | 0.80 | CTSK (0.62) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16636267 | 0.80 | CTSK (0.62) | CTSKCTSBCTSSKCNH2 |
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-2015051479-A1 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2015-04-16 | — | — | WO | disclosed |