Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 2/20 | 0.31 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.30 |
| ▸ | CIT | O14578 | 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 | |
|---|---|---|---|---|
| SCHEMBL4698852 | 0.89 | CTSK (0.39) | CTSB | |
| SCHEMBL4699954 | 0.87 | CTSL (0.37) | CTSB | |
| SCHEMBL4702624 | 0.83 | RORC (0.40) | CTSB | |
| SCHEMBL6235527 | 0.82 | CTSL (0.44) | CTSB | |
| SCHEMBL4704763 | 0.81 | CTSS (0.43) | CTSB | |
| SCHEMBL4703889 | 0.80 | CTSS (0.37) | CTSB | |
| SCHEMBL4702315 | 0.79 | AAK1 (0.33) | CTSBAAK1CIT | |
| SCHEMBL4704247 | 0.79 | DPP4 (0.33) | — | |
| SCHEMBL4701287 | 0.76 | CTSL (0.35) | CTSB | |
| SCHEMBL4703732 | 0.75 | ME2 (0.43) | CTSB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1372655-B1 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK FROSST CANADA LTD (CA) | 2008-10-01 | — | — | EP | disclosed |