Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 19/20 | 0.62 |
| ▸ | CTSB | P07858 | 7/20 | 0.58 |
| ▸ | CTSS | P25774 | 4/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.55 |
| ▸ | CTSL | P07711 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL8100091 | 0.96 | CTSK (0.62) | CTSKCTSBCTSSKCNH2CTSL | |
| SCHEMBL4789866 | 0.88 | CTSK (0.70) | CTSKCTSBCTSSKCNH2CTSL | |
| SCHEMBL8105897 | 0.83 | CTSK (0.56) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL8108547 | 0.83 | CTSK (0.67) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL4757161 | 0.82 | CTSK (0.69) | CTSKCTSBCTSSKCNH2CTSL | |
| SCHEMBL8111663 | 0.82 | CTSK (0.69) | CTSKCTSBCTSSKCNH2CTSL | |
| SCHEMBL8100014 | 0.82 | CTSK (0.60) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL8121853 | 0.82 | CTSK (0.67) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL8107252 | 0.82 | CTSK (0.67) | CTSKCTSBCTSSKCNH2 | |
| SCHEMBL8121594 | 0.81 | CTSK (0.60) | 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-2009001128-A1 | 1,2-CYCL0HEXANE DICARBOXAMIDES AS CATHEPSIN INHIBITORS | ASTRAZENECA AB (SE) | 2008-12-31 | — | — | WO | disclosed |