Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 7/20 | 0.48 |
| ▸ | CTSL | P07711 | 5/20 | 0.48 |
| ▸ | CTSB | P07858 | 2/20 | 0.48 |
| ▸ | CTSS | P25774 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CTSV | O60911 | 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 | |
|---|---|---|---|---|
| SCHEMBL5529224 | 0.90 | NPC1 (0.50) | CTSKCTSLCTSBCTSSSMN1; SMN2 | |
| SCHEMBL5523266 | 0.89 | CTSK (0.47) | CTSKCTSLCTSBCTSSLMNA | |
| SCHEMBL5526078 | 0.89 | CTSL (0.47) | CTSKCTSLCTSBCTSSLMNA | |
| SCHEMBL5525371 | 0.89 | RAB9A (0.49) | CTSKCTSLCTSBCTSSCTSV | |
| SCHEMBL5525342 | 0.87 | CTSL (0.60) | CTSKCTSLCTSBCTSSLMNA | |
| SCHEMBL5520555 | 0.87 | KCNA3 (0.49) | CTSKCTSLCTSBCTSSKMT2A | |
| SCHEMBL5526253 | 0.87 | HPGD (0.51) | CTSKCTSLCTSBCTSSLMNA | |
| SCHEMBL7564802 | 0.86 | CTSL (0.46) | CTSKCTSLCTSBCTSSLMNA | |
| SCHEMBL5525920 | 0.84 | CTSL (0.46) | CTSKCTSLCTSBCTSS | |
| SCHEMBL5534377 | 0.82 | CTSL (0.49) | CTSKCTSLCTSBCTSSKMT2A |
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-1178958-A2 | N-CYANOMETHYL AMIDES AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2002-02-13 | — | — | EP | disclosed |
| WO-2000055125-A2 | N-CYANOMETHYL AMIDES AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2000-09-21 | — | — | WO | disclosed |