Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 14/20 | 0.40 |
| ▸ | CTSK | P43235 | 13/20 | 0.40 |
| ▸ | CTSL | P07711 | 13/20 | 0.37 |
| ▸ | CTSB | P07858 | 12/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.32 |
| ▸ | EP300 | Q09472 | 1/20 | 0.30 |
| ▸ | IDH1 | O75874 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4703971 | 0.90 | CTSS (0.37) | CTSSCTSKCTSLCTSB | |
| SCHEMBL4699979 | 0.89 | CTSS (0.44) | CTSSCTSKCTSLCTSBTNIK | |
| SCHEMBL4703010 | 0.89 | CTSS (0.37) | CTSSCTSKCTSLCTSB | |
| SCHEMBL4701237 | 0.89 | CTSS (0.36) | CTSSCTSKCTSLCTSB | |
| SCHEMBL4701807 | 0.88 | TGFBR1 (0.36) | CTSSCTSKCTSLCTSBTNIK | |
| SCHEMBL4699905 | 0.87 | CTSS (0.41) | CTSSCTSKCTSLCTSB | |
| SCHEMBL4703250 | 0.86 | CTSL (0.46) | CTSSCTSKCTSLCTSB | |
| SCHEMBL4703327 | 0.86 | CTSL (0.46) | CTSSCTSKCTSLCTSB | |
| SCHEMBL4702728 | 0.86 | RORC (0.35) | CTSSCTSKCTSLCTSB | |
| SCHEMBL4701723 | 0.86 | KDM4E (0.35) | CTSSCTSKCTSLCTSB |
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-1372655-B1 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK FROSST CANADA LTD (CA) | 2008-10-01 | — | — | EP | disclosed |