Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 20/20 | 0.71 |
| ▸ | CTSK | P43235 | 8/20 | 0.71 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL16045001 | 0.83 | CTSC (1.00) | CTSCCTSK | |
| SCHEMBL16478189 | 0.83 | CTSC (0.67) | CTSCCTSKKCNH2 | |
| SCHEMBL16485751 | 0.83 | CTSC (0.67) | CTSCCTSKKCNH2 | |
| SCHEMBL16622364 | 0.82 | CTSC (1.00) | CTSCCTSK | |
| SCHEMBL19187807 | 0.82 | CTSC (0.73) | CTSCCTSK | |
| SCHEMBL15084142 | 0.82 | CTSC (0.73) | CTSCCTSK | |
| SCHEMBL16478368 | 0.81 | CTSC (0.50) | CTSCCTSK | |
| SCHEMBL16214766 | 0.81 | CTSC (0.68) | CTSCCTSK | |
| SCHEMBL16478351 | 0.80 | CTSC (0.72) | CTSCCTSKKCNH2 | |
| SCHEMBL19186902 | 0.78 | CTSC (0.60) | CTSCCTSK |
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-2011154677-A1 | SUBSTITUTED N-[1-CYANO-2-(PHENYL)ETHYL] 1-AMINOCYCLOALK-1-YLCARBOXAMIDE COMPOUNDS - 760 | ASTRAZENECA AB (SE) | 2011-12-15 | — | — | WO | disclosed |