Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 18/20 | 0.56 |
| ▸ | CTSB | P07858 | 15/20 | 0.56 |
| ▸ | CTSF | Q9UBX1 | 11/20 | 0.56 |
| ▸ | CTSS | P25774 | 9/20 | 0.56 |
| ▸ | CTSK | P43235 | 9/20 | 0.56 |
| ▸ | CTSV | O60911 | 3/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL2921217 | 0.83 | CTSL (0.78) | CTSLCTSBCTSFCTSSCTSK | |
| SCHEMBL2922411 | 0.75 | CTSL (0.65) | CTSLCTSBCTSFCTSSCTSK | |
| SCHEMBL3036190 | 0.73 | CTSL (0.51) | CTSLCTSBCTSFCTSSCTSK | |
| SCHEMBL3767027 | 0.72 | CTSL (1.00) | CTSLCTSBCTSFCTSSCTSK | |
| SCHEMBL2919168 | 0.72 | CTSL (1.00) | CTSLCTSBCTSFCTSSCTSK | |
| SCHEMBL3767031 | 0.72 | CTSL (1.00) | CTSLCTSBCTSFCTSSCTSK | |
| SCHEMBL12999181 | 0.72 | CTSL (0.78) | CTSLCTSBCTSFCTSSCTSK | |
| SCHEMBL3760637 | 0.71 | CTSL (1.00) | CTSLCTSBCTSFCTSSCTSK | |
| SCHEMBL3760635 | 0.71 | CTSL (1.00) | CTSLCTSBCTSFCTSSCTSK | |
| SCHEMBL3760645 | 0.71 | CTSL (1.00) | CTSLCTSBCTSFCTSSCTSK |
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-2225196-A1 | CYSTEINE PROTEASE INHIBITORS FOR THE TREATMENT OF PARASITIC DISEASES | Merck Frosst Canada Ltd. (CA) | 2010-09-08 | — | — | EP | disclosed |
| WO-2009067797-A1 | CYSTEINE PROTEASE INHIBITORS FOR THE TREATMENT OF PARASITIC DISEASES | MERCK FROSST CANADA LTD. (CA) | 2009-06-04 | — | — | WO | disclosed |