Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 20/20 | 0.76 |
| ▸ | CTSL | P07711 | 1/20 | 0.55 |
| ▸ | CTSB | P07858 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL6803876 | 0.91 | CTSS (0.78) | CTSSCTSLCTSB | |
| SCHEMBL7543430 | 0.91 | CTSS (0.75) | CTSSCTSLCTSB | |
| SCHEMBL6803365 | 0.87 | CTSS (0.72) | CTSSCTSLCTSB | |
| SCHEMBL7062841 | 0.87 | CTSS (1.00) | CTSSCTSLCTSB | |
| SCHEMBL6803678 | 0.86 | CTSS (0.71) | CTSSCTSL | |
| SCHEMBL7393092 | 0.85 | CTSS (1.00) | CTSSCTSL | |
| SCHEMBL7396399 | 0.83 | CTSS (0.85) | CTSSCTSL | |
| SCHEMBL7023918 | 0.83 | CTSS (0.66) | CTSSCTSLCTSB | |
| SCHEMBL7388412 | 0.81 | CTSS (0.71) | CTSS | |
| SCHEMBL7566545 | 0.81 | CTSS (0.91) | CTSSCTSL |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1159273-A1 | COMPOUNDS USEFUL AS REVERSIBLE INHIBITORS OF CATHEPSIN S | BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) | 2001-12-05 | — | — | EP | disclosed |
| WO-2000051998-A1 | COMPOUNDS USEFUL AS REVERSIBLE INHIBITORS OF CATHEPSIN S | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2000-09-08 | — | — | WO | disclosed |