Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 18/20 | 0.76 |
| ▸ | CTSB | P07858 | 17/20 | 0.76 |
| ▸ | CTSK | P43235 | 17/20 | 0.76 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8226527 | 0.92 | CTSB (0.79) | CTSSCTSBCTSKPOLB | |
| SCHEMBL8223388 | 0.89 | CTSB (0.70) | CTSSCTSBCTSKPOLB | |
| SCHEMBL10238403 | 0.88 | CTSB (0.61) | CTSSCTSBCTSK | |
| SCHEMBL346132 | 0.87 | CTSB (0.72) | CTSSCTSBCTSKCYP3A4SMN1; SMN2 | |
| SCHEMBL346133 | 0.87 | CTSB (0.72) | CTSSCTSBCTSKCYP3A4SMN1; SMN2 | |
| SCHEMBL346505 | 0.87 | CTSB (1.00) | CTSSCTSBCTSK | |
| SCHEMBL8218593 | 0.85 | CTSB (0.70) | CTSSCTSBCTSKPOLB | |
| SCHEMBL346100 | 0.85 | CTSB (0.68) | CTSSCTSBCTSKCYP3A4SMN1; SMN2 | |
| SCHEMBL346098 | 0.85 | CTSB (0.68) | CTSSCTSBCTSKCYP3A4SMN1; SMN2 | |
| SCHEMBL347247 | 0.84 | CTSS (0.77) | CTSSCTSBCTSK |
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-2007137738-A1 | SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS | SANOFI-AVENTIS (DE) | 2007-12-06 | — | — | WO | disclosed |