Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 20/20 | 0.65 |
| ▸ | CTSL | P07711 | 12/20 | 0.65 |
| ▸ | CTSB | P07858 | 12/20 | 0.65 |
| ▸ | CTSK | P43235 | 11/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7528445 | 0.94 | CTSS (0.74) | CTSSCTSLCTSBCTSK | |
| SCHEMBL7530137 | 0.84 | CTSS (0.62) | CTSSCTSLCTSBCTSK | |
| SCHEMBL7530008 | 0.84 | CTSK (0.63) | CTSSCTSLCTSBCTSK | |
| SCHEMBL7530187 | 0.82 | CTSS (0.57) | CTSSCTSLCTSBCTSKCYP3A4 | |
| SCHEMBL7532290 | 0.82 | CTSS (0.58) | CTSSCTSLCTSBCTSK | |
| SCHEMBL7533061 | 0.81 | CTSS (0.56) | CTSSCTSLCTSBCTSK | |
| SCHEMBL7526705 | 0.80 | CTSS (0.55) | CTSSCTSLCTSBCTSKCYP3A4 | |
| SCHEMBL7530384 | 0.80 | CTSL (0.47) | CTSSCTSLCTSBCTSK | |
| SCHEMBL7531164 | 0.80 | CTSS (0.54) | CTSSCTSLCTSBCTSKCYP3A4 | |
| SCHEMBL7533810 | 0.79 | CTSL (0.54) | CTSSCTSLCTSBCTSK |
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-2002023784-A2 | CYSTEINE PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2002-03-21 | — | — | WO | claimed |
| WO-2002023784-A2 | CYSTEINE PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2002-03-21 | — | — | WO | disclosed |