Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 20/20 | 0.78 |
| ▸ | CTSS | P25774 | 19/20 | 0.78 |
| ▸ | CTSL | P07711 | 18/20 | 0.78 |
| ▸ | CTSB | P07858 | 16/20 | 0.78 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4760512 | 0.96 | CTSK (0.78) | CTSKCTSSCTSLCTSBKCNH2 | |
| SCHEMBL4790513 | 0.92 | CTSK (0.78) | CTSKCTSSCTSLCTSBKCNH2 | |
| SCHEMBL4760896 | 0.88 | CTSK (0.72) | CTSKCTSSCTSLCTSBKCNH2 | |
| SCHEMBL4716426 | 0.88 | CTSK (1.00) | CTSKCTSSCTSLCTSB | |
| SCHEMBL4717266 | 0.84 | CTSK (0.79) | CTSKCTSSCTSLCTSB | |
| SCHEMBL4714257 | 0.84 | CTSL (1.00) | CTSKCTSSCTSLCTSB | |
| SCHEMBL4761353 | 0.83 | CTSK (1.00) | CTSKCTSSCTSLCTSB | |
| SCHEMBL6183387 | 0.80 | CTSK (0.60) | CTSKCTSSCTSLCTSB | |
| SCHEMBL7606091 | 0.80 | CTSK (0.60) | CTSKCTSSCTSLCTSB | |
| SCHEMBL4713651 | 0.80 | CTSK (0.79) | CTSKCTSSCTSLCTSB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1248612-B1 | NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEASE INHIBITORS | MERCK FROSST CANADA LTD (CA) | 2008-02-27 | — | — | EP | claimed |