Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 18/20 | 0.60 |
| ▸ | CTSK | P43235 | 2/20 | 0.49 |
| ▸ | STIM1 | Q13586 | 2/20 | 0.42 |
| ▸ | ORAI1 | Q96D31 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15083944 | 0.78 | CTSC (0.64) | CTSCCTSKSTIM1ORAI1 | |
| SCHEMBL14821860 | 0.78 | CTSC (0.67) | CTSCCTSK | |
| SCHEMBL15083963 | 0.76 | CTSC (0.77) | CTSCCTSK | |
| SCHEMBL14822271 | 0.75 | CTSC (1.00) | CTSCCTSK | |
| SCHEMBL19188085 | 0.72 | CTSC (0.61) | CTSCCTSK | |
| SCHEMBL15084058 | 0.69 | CTSC (0.62) | CTSCCTSK | |
| SCHEMBL14821863 | 0.69 | CTSC (0.66) | CTSCCTSK | |
| SCHEMBL15083932 | 0.68 | CTSC (0.67) | CTSCCTSK | |
| SCHEMBL15084137 | 0.67 | CTSC (0.76) | CTSCCTSK | |
| SCHEMBL14821864 | 0.66 | CTSC (0.64) | 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 |
|---|---|---|---|---|---|---|---|
| EP-2758398-B1 | SUBSTITUTED N- [1-CYANO-2- (PHENYL) ETHYL]-2-AZABICYCLO [2.2.1]HEPTANE-3-CARBOXAMIDE INHIBITORS OF CATHEPSIN C | BOEHRINGER INGELHEIM INT (DE) | 2017-08-02 | — | — | EP | disclosed |