Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 2/20 | 0.37 |
| ▸ | CTSB | P07858 | 2/20 | 0.37 |
| ▸ | CTSS | P25774 | 2/20 | 0.37 |
| ▸ | CTSK | P43235 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 12/20 | 0.36 |
| ▸ | CA1 | P00915 | 7/20 | 0.36 |
| ▸ | CA7 | P43166 | 2/20 | 0.36 |
| ▸ | CA4 | P22748 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 5/20 | 0.35 |
| ▸ | PPID | Q08752 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 4/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
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 | 0.87 | CTSK (0.39) | CTSLCTSBCTSSCTSK | |
| SCHEMBL4700965 | 0.87 | BRD4 (0.36) | CTSB | |
| SCHEMBL6235527 | 0.81 | CTSL (0.44) | CTSLCTSBCTSSCTSK | |
| SCHEMBL4702624 | 0.80 | RORC (0.40) | CTSLCTSBCTSSCTSK | |
| SCHEMBL4704763 | 0.79 | CTSS (0.43) | CTSLCTSBCTSSCTSK | |
| SCHEMBL4703889 | 0.79 | CTSS (0.37) | CTSLCTSBCTSSCTSKALDH1A1 | |
| SCHEMBL4704247 | 0.78 | DPP4 (0.33) | — | |
| SCHEMBL4701287 | 0.77 | CTSL (0.35) | CTSLCTSBCTSSCTSK | |
| SCHEMBL4703732 | 0.74 | ME2 (0.43) | CTSLCTSBCTSSCTSKCA2 | |
| SCHEMBL4701995 | 0.74 | CTSK (0.37) | CTSLCTSBCTSSCTSKCA2 |
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 |