Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 9/20 | 0.46 |
| ▸ | CTSL | P07711 | 9/20 | 0.46 |
| ▸ | CTSB | P07858 | 4/20 | 0.46 |
| ▸ | CTSK | P43235 | 6/20 | 0.45 |
| ▸ | CTSC | P53634 | 2/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL5526400 | 0.78 | CTSS (0.44) | CTSSCTSLCTSBCTSK | |
| SCHEMBL6467489 | 0.76 | CYP2C19 (0.46) | — | |
| SCHEMBL7544294 | 0.75 | CTSC (0.51) | CTSSCTSLCTSBCTSKCTSC | |
| Hydrochloric Acid SCHEMBL6467921 | 0.75 | IDO1 (0.45) | — | |
| SCHEMBL6742393 | 0.74 | CTSS (0.49) | CTSSCTSLCTSBCTSKATM | |
| SCHEMBL3622046 | 0.73 | CTSS (0.41) | CTSSCTSLCTSBCTSK | |
| SCHEMBL10612693 | 0.73 | CTSS (0.66) | CTSSCTSLCTSBCTSKMCL1 | |
| SCHEMBL5524114 | 0.71 | CTSL (0.56) | CTSSCTSLCTSBCTSK | |
| SCHEMBL16626138 | 0.71 | CTSS (0.67) | CTSSCTSLCTSBCTSKCTSC | |
| SCHEMBL5456972 | 0.71 | CTSS (0.67) | CTSSCTSLCTSBCTSKCTSC |
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 |
|---|---|---|---|---|---|---|---|
| EP-1212302-A1 | COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS AS CATHEPSIN S INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2002-06-12 | — | — | EP | disclosed |
| WO-2001019796-A1 | COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS AS CATHEPSIN S INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2001-03-22 | — | — | WO | disclosed |