Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 18/20 | 0.36 |
| ▸ | CTSB | P07858 | 6/20 | 0.35 |
| ▸ | CTSS | P25774 | 6/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16638098 | 0.85 | CTSK (0.36) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL24018937 | 0.84 | CTSK (0.44) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16635816 | 0.82 | CTSK (0.46) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16636012 | 0.82 | CTSK (0.46) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16635817 | 0.82 | CTSK (0.40) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16635819 | 0.82 | CTSK (0.42) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16636013 | 0.82 | CTSK (0.40) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16636227 | 0.81 | CTSK (0.46) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16636229 | 0.81 | CTSK (0.53) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL16636205 | 0.81 | CTSK (0.41) | 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 |