Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 20/20 | 0.66 |
| ▸ | CTSB | P07858 | 11/20 | 0.46 |
| ▸ | CTSS | P25774 | 8/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16636087 | 1.00 | CTSK (0.66) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16635873 | 0.96 | CTSK (0.65) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16636084 | 0.94 | CTSK (0.75) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16635955 | 0.94 | CTSK (0.66) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16637860 | 0.94 | CTSK (0.75) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16636700 | 0.94 | CTSK (0.68) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16635973 | 0.93 | CTSK (0.67) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16636109 | 0.92 | CTSK (0.64) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16636437 | 0.92 | CTSK (0.65) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16635871 | 0.90 | CTSK (0.73) | 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 |