Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 20/20 | 0.68 |
| ▸ | CTSL | P07711 | 14/20 | 0.68 |
| ▸ | CTSS | P25774 | 15/20 | 0.64 |
| ▸ | CTSB | P07858 | 12/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL4717655 | 0.89 | CTSK (0.69) | CTSKCTSLCTSSCTSB | |
| SCHEMBL4714588 | 0.88 | CTSL (0.77) | CTSKCTSLCTSSCTSB | |
| SCHEMBL4713675 | 0.88 | CTSK (0.78) | CTSKCTSLCTSSCTSB | |
| SCHEMBL4712362 | 0.78 | CTSK (1.00) | CTSKCTSLCTSSCTSB | |
| SCHEMBL4713519 | 0.78 | CTSK (1.00) | CTSKCTSLCTSSCTSB | |
| SCHEMBL4716044 | 0.78 | CTSK (1.00) | CTSKCTSLCTSSCTSB | |
| SCHEMBL4715902 | 0.77 | CTSK (0.84) | CTSKCTSLCTSSCTSB | |
| SCHEMBL4712035 | 0.76 | CTSK (1.00) | CTSKCTSLCTSSCTSB | |
| SCHEMBL4714581 | 0.75 | CTSK (1.00) | CTSKCTSLCTSSCTSB | |
| SCHEMBL1587727 | 0.75 | CTSK (1.00) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2001049288-A9 | NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEASE INHIBITORS | MERCK FROSST CANADA INC (CA) | 2001-10-25 | — | — | WO | claimed |
| WO-2001049288-A9 | NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEASE INHIBITORS | MERCK FROSST CANADA INC (CA) | 2001-10-25 | — | — | WO | disclosed |