Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ME2 | P23368 | 1/20 | 0.43 |
| ▸ | ME1 | P48163 | 1/20 | 0.43 |
| ▸ | ME3 | Q16798 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | REV1 | Q9UBZ9 | 2/20 | 0.43 |
| ▸ | DRD4 | P21917 | 2/20 | 0.41 |
| ▸ | CETP | P11597 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA7 | P43166 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CTSS | P25774 | 2/20 | 0.39 |
| ▸ | CTSK | P43235 | 2/20 | 0.39 |
| ▸ | CTSL | P07711 | 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 | |
|---|---|---|---|---|
| SCHEMBL4703889 | 0.88 | CTSS (0.37) | GAAALDH1A1CTSSCTSKCTSL | |
| SCHEMBL4702624 | 0.83 | RORC (0.40) | CTSSCTSKCTSLCTSBGFER | |
| SCHEMBL4704763 | 0.83 | CTSS (0.43) | CTSSCTSKCTSLCTSB | |
| SCHEMBL6235527 | 0.82 | CTSL (0.44) | CTSSCTSKCTSLCTSB | |
| SCHEMBL4698852 | 0.81 | CTSK (0.39) | CTSSCTSKCTSLCTSB | |
| SCHEMBL4703554 | 0.78 | CTSS (0.51) | ME2ME1ME3GAAREV1 | |
| SCHEMBL4700965 | 0.75 | BRD4 (0.36) | CTSB | |
| SCHEMBL4699954 | 0.74 | CTSL (0.37) | ALDH1A1CA1CA2CA7CA12 | |
| SCHEMBL4701287 | 0.71 | CTSL (0.35) | CTSSCTSKCTSLCTSB | |
| SCHEMBL4703010 | 0.70 | CTSS (0.37) | CTSSCTSKCTSLCTSB |
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 |