Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 13/20 | 0.67 |
| ▸ | CTSL | P07711 | 9/20 | 0.67 |
| ▸ | CTSK | P43235 | 7/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL6693584 | 0.93 | CTSS (0.66) | CTSSCTSLCTSKALDH1A1LMNA | |
| SCHEMBL6690317 | 0.93 | CTSS (0.70) | CTSSCTSLCTSKALDH1A1LMNA | |
| SCHEMBL6692874 | 0.89 | CTSS (0.67) | CTSSCTSLCTSKALDH1A1LMNA | |
| SCHEMBL4796898 | 0.83 | CTSS (0.76) | CTSSCTSLCTSK | |
| SCHEMBL4800983 | 0.82 | CTSS (0.69) | CTSSCTSLCTSK | |
| SCHEMBL4800988 | 0.82 | CTSS (0.69) | CTSSCTSLCTSK | |
| SCHEMBL4797808 | 0.80 | CTSL (1.00) | CTSSCTSLCTSK | |
| SCHEMBL4797798 | 0.80 | CTSL (1.00) | CTSSCTSLCTSK | |
| SCHEMBL4795483 | 0.80 | CTSS (0.75) | CTSSCTSLCTSK | |
| SCHEMBL4800309 | 0.79 | CTSS (0.54) | CTSSCTSLCTSKALDH1A1LMNA |
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-2004084843-A2 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2004-10-07 | — | — | WO | disclosed |