Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 14/20 | 0.42 |
| ▸ | CTSL | P07711 | 9/20 | 0.42 |
| ▸ | CTSS | P25774 | 8/20 | 0.42 |
| ▸ | CTSB | P07858 | 7/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1199851 | 0.87 | CTSL (0.58) | CTSKCTSLCTSSCTSB | |
| SCHEMBL1199853 | 0.87 | CTSL (0.58) | CTSKCTSLCTSSCTSB | |
| SCHEMBL7993310 | 0.84 | CTSL (0.41) | CTSKCTSLCTSSCTSB | |
| SCHEMBL12890102 | 0.83 | CTSK (0.43) | CTSKCTSLCTSSCTSB | |
| SCHEMBL14305980 | 0.80 | CTSL (0.37) | CTSKCTSLCTSSCTSB | |
| SCHEMBL14315244 | 0.79 | CTSL (0.56) | CTSKCTSLCTSSCTSB | |
| SCHEMBL1200545 | 0.76 | CTSS (0.72) | CTSKCTSLCTSSCTSB | |
| SCHEMBL1200546 | 0.76 | CTSS (0.72) | CTSKCTSLCTSSCTSB | |
| SCHEMBL12417819 | 0.76 | CTSS (0.49) | CTSKCTSLCTSSCTSB | |
| SCHEMBL14315245 | 0.73 | CTSL (0.60) | CTSKCTSLCTSSCTSB |
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-2009123623-A1 | DI-FLUORO CONTAINING COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS | VIROBAY, INC. (US) | 2009-10-08 | — | — | WO | disclosed |