Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 15/20 | 0.48 |
| ▸ | CTSL | P07711 | 12/20 | 0.48 |
| ▸ | CTSB | P07858 | 7/20 | 0.48 |
| ▸ | CTSK | P43235 | 14/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6446070 | 0.91 | CTSS (0.48) | CTSSCTSLCTSBCTSK | |
| SCHEMBL6443381 | 0.90 | CYP2D6 (0.40) | CTSSCTSLCTSBCTSKCYP2D6 | |
| SCHEMBL6444054 | 0.90 | CTSS (0.50) | CTSSCTSLCTSBCTSKCYP2D6 | |
| SCHEMBL6442277 | 0.89 | NPC1 (0.49) | CTSSCTSLCTSBCTSK | |
| SCHEMBL6184244 | 0.89 | CTSS (0.62) | CTSSCTSLCTSBCTSK | |
| SCHEMBL6443843 | 0.89 | CTSK (0.51) | CTSSCTSLCTSBCTSK | |
| SCHEMBL6443710 | 0.88 | NPC1 (0.54) | CTSSCTSLCTSBCTSK | |
| SCHEMBL6443700 | 0.87 | CTSS (0.54) | CTSSCTSLCTSBCTSK | |
| SCHEMBL6445274 | 0.86 | CTSS (0.60) | CTSSCTSLCTSBCTSK | |
| SCHEMBL6444220 | 0.86 | CTSS (0.44) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004056755-A2 | COMPOUNDS FOR THE INHIBITION OF NON-PROTEOLYTIC ENZYMES | JERENI AG (DE) | 2004-07-08 | — | — | WO | disclosed |