Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 2/20 | 0.39 |
| ▸ | CTSL | P07711 | 2/20 | 0.39 |
| ▸ | CTSS | P25774 | 2/20 | 0.39 |
| ▸ | DPP4 | P27487 | 3/20 | 0.33 |
| ▸ | CTSK | P43235 | 3/20 | 0.31 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.30 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4701834 | 1.00 | CTSB (0.39) | CTSBCTSLCTSSDPP4CTSK | |
| SCHEMBL4700000 | 0.84 | CTSB (0.34) | CTSBCTSLCTSSCTSKAAK1 | |
| SCHEMBL4701624 | 0.80 | CTSL (0.42) | CTSBCTSLCTSSDPP4SLC7A5 | |
| SCHEMBL4701582 | 0.79 | CTSL (0.33) | CTSBCTSLCTSSDPP4 | |
| SCHEMBL4702315 | 0.79 | AAK1 (0.33) | CTSBCTSLCTSSCTSKAAK1 | |
| SCHEMBL4703534 | 0.78 | GSK3B (0.33) | CTSLCTSSCTSKAAK1 | |
| SCHEMBL4703740 | 0.78 | CTSL (0.33) | CTSLCTSSDPP4CTSKAAK1 | |
| SCHEMBL4704401 | 0.78 | CTSL (0.34) | CTSBCTSLCTSSDPP4AAK1 | |
| SCHEMBL6208762 | 0.78 | CTSL (0.34) | CTSBCTSLCTSSDPP4AAK1 | |
| SCHEMBL6208514 | 0.77 | CTSL (0.37) | CTSBCTSLCTSS |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1372655-A4 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK FROSST CANADA INC (CA) | 2005-10-12 | — | — | EP | disclosed |
| EP-1372655-A2 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | Merck Frosst Canada & Co. (CA) | 2004-01-02 | — | — | EP | disclosed |
| WO-2002069901-A2 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK FROSST CANADA & CO. (CA) | 2002-09-12 | — | — | WO | disclosed |