Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 10/20 | 0.34 |
| ▸ | CTSB | P07858 | 9/20 | 0.34 |
| ▸ | CTSK | P43235 | 9/20 | 0.34 |
| ▸ | CTSL | P07711 | 8/20 | 0.34 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 2/20 | 0.33 |
| ▸ | JAK1 | P23458 | 2/20 | 0.33 |
| ▸ | JAK3 | P52333 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | TBK1 | Q9UHD2 | 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 | |
|---|---|---|---|---|
| SCHEMBL4701807 | 0.89 | TGFBR1 (0.36) | KDM4ECTSSCTSBCTSKCTSL | |
| SCHEMBL4699905 | 0.88 | CTSS (0.41) | CTSSCTSBCTSKCTSLJAK2 | |
| SCHEMBL4703250 | 0.88 | CTSL (0.46) | CTSSCTSBCTSKCTSL | |
| SCHEMBL4703327 | 0.88 | CTSL (0.46) | CTSSCTSBCTSKCTSL | |
| SCHEMBL4699979 | 0.87 | CTSS (0.44) | CTSSCTSBCTSKCTSL | |
| SCHEMBL4701237 | 0.87 | CTSS (0.36) | CTSSCTSBCTSKCTSLTBK1 | |
| SCHEMBL4702728 | 0.87 | RORC (0.35) | KDM4ECTSSCTSBCTSKCTSL | |
| SCHEMBL4703010 | 0.87 | CTSS (0.37) | CTSSCTSBCTSKCTSL | |
| SCHEMBL4703971 | 0.86 | CTSS (0.37) | CTSSCTSBCTSKCTSL | |
| SCHEMBL4702148 | 0.86 | CTSS (0.40) | CTSSCTSBCTSKCTSL |
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 |