Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CSNK2A1 | P68400 | 6/20 | 0.49 |
| ▸ | CTSL | P07711 | 4/20 | 0.47 |
| ▸ | CTSS | P25774 | 4/20 | 0.47 |
| ▸ | CTSB | P07858 | 3/20 | 0.47 |
| ▸ | CTSK | P43235 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | NAMPT | P43490 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | PTGES | O14684 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | VCP | P55072 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6266978 | 0.87 | CTSL (0.43) | CSNK2A1CTSLCTSSCTSBCTSK | |
| SCHEMBL6184065 | 0.83 | CTSS (0.68) | CSNK2A1CTSLCTSSCTSBCTSK | |
| SCHEMBL7449461 | 0.80 | CTSS (0.47) | CTSLCTSSCTSBCTSKMEN1 | |
| SCHEMBL6184002 | 0.79 | CTSB (0.60) | CSNK2A1CTSLCTSSCTSBCTSK | |
| SCHEMBL5525516 | 0.79 | CTSK (0.53) | CTSLCTSSCTSBCTSK | |
| SCHEMBL6265313 | 0.76 | CTSK (0.41) | CTSLCTSSCTSBCTSKSMN1; SMN2 | |
| SCHEMBL6183917 | 0.76 | CTSB (0.58) | CSNK2A1CTSLCTSSCTSBCTSK | |
| SCHEMBL6181726 | 0.76 | CTSL (0.56) | CSNK2A1CTSLCTSSCTSBCTSK | |
| SCHEMBL6442146 | 0.75 | CTSK (0.48) | CTSLCTSSCTSBCTSKMEN1 | |
| SCHEMBL6266969 | 0.74 | CTSL (0.53) | CTSLCTSSCTSBCTSKNAMPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001068645-A2 | N-CYANOMETHYLCARBOXAMIDES AND THEIR USE AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2001-09-20 | — | — | WO | claimed |