Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 20/20 | 0.48 |
| ▸ | CTSK | P43235 | 5/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL16478153 | 0.91 | CTSC (0.51) | CTSCCTSKKCNH2 | |
| SCHEMBL16485779 | 0.88 | ITGA4 (0.37) | CTSCCTSKKCNH2 | |
| SCHEMBL16478079 | 0.85 | CTSC (0.57) | CTSCCTSKKCNH2 | |
| SCHEMBL16485786 | 0.85 | CTSC (0.57) | CTSCCTSKKCNH2 | |
| SCHEMBL2890558 | 0.83 | CTSC (0.62) | CTSCCTSKKCNH2 | |
| SCHEMBL2890557 | 0.83 | CTSC (0.62) | CTSCCTSKKCNH2 | |
| SCHEMBL16485823 | 0.82 | CTSC (0.42) | CTSCCTSKKCNH2 | |
| SCHEMBL16485773 | 0.82 | CTSC (0.49) | CTSCCTSKKCNH2 | |
| SCHEMBL16478308 | 0.80 | CTSC (0.43) | CTSCCTSKKCNH2 | |
| SCHEMBL16478307 | 0.80 | CTSC (0.43) | CTSCCTSKKCNH2 |
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 |