Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 19/20 | 0.61 |
| ▸ | PREP | P48147 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16622340 | 0.90 | CTSC (0.60) | CTSCPREPCTSK | |
| SCHEMBL15081675 | 0.90 | CTSC (0.59) | CTSCPREPCTSK | |
| SCHEMBL16622331 | 0.88 | CTSC (0.60) | CTSCPREPCTSK | |
| SCHEMBL16622354 | 0.87 | CTSC (0.61) | CTSCPREPCTSK | |
| SCHEMBL15084108 | 0.87 | CTSC (0.45) | CTSCPREP | |
| SCHEMBL15083940 | 0.87 | CTSC (0.58) | CTSCCTSK | |
| SCHEMBL15081670 | 0.86 | CTSC (0.53) | CTSCPREP | |
| SCHEMBL15081681 | 0.85 | CTSC (0.61) | CTSCPREPCTSK | |
| SCHEMBL14822236 | 0.84 | CTSC (0.62) | CTSCPREPCTSK | |
| SCHEMBL15081663 | 0.84 | CTSC (0.53) | CTSCPREP |
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 |
|---|---|---|---|---|---|---|---|
| US-8999975-B2 | Substituted N- [1-cyano-2- (phenyl) ethyl] -2-azabicyclo [2.2.1] heptane-3-carboxamide inhibitors of cathepsin C | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2015-04-07 | — | — | US | disclosed |