Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 2/20 | 0.35 |
| ▸ | JAK1 | P23458 | 2/20 | 0.35 |
| ▸ | CTSC | P53634 | 2/20 | 0.31 |
| ▸ | DPP4 | P27487 | 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 | |
|---|---|---|---|---|
| SCHEMBL6255595 | 0.88 | CNR2 (0.35) | JAK2JAK1CTSC | |
| SCHEMBL2924445 | 0.70 | DGAT1 (0.36) | JAK2JAK1 | |
| SCHEMBL6252505 | 0.67 | — | — | |
| SCHEMBL6250620 | 0.67 | CTSL (0.38) | CTSC | |
| SCHEMBL4239023 | 0.67 | CTSL (0.34) | CTSC | |
| SCHEMBL4246964 | 0.67 | CTSL (0.37) | CTSC | |
| SCHEMBL5365890 | 0.66 | CTSC (0.32) | CTSC | |
| SCHEMBL6194995 | 0.66 | DGAT1 (0.40) | — | |
| SCHEMBL4247124 | 0.65 | CTSL (0.37) | — | |
| SCHEMBL4245581 | 0.63 | CTSL (0.39) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1569954-A1 | CYANOMETHYL DERIVATIVES AS CYSTEINE PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2005-09-07 | — | — | EP | disclosed |
| WO-2004052921-A1 | CYANOMETHYL DERIVATIVES AS CYSTEINE PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2004-06-24 | — | — | WO | disclosed |