Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 8/20 | 0.46 |
| ▸ | TSPO | P30536 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.34 |
| ▸ | KMO | O15229 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL290462 | 0.96 | CTSC (0.46) | CTSCTSPOKCNH2ASAH1 | |
| SCHEMBL290319 | 0.89 | CTSC (0.42) | CTSCKCNH2ASAH1 | |
| SCHEMBL290292 | 0.86 | CTSC (0.47) | CTSCKCNH2 | |
| SCHEMBL2890775 | 0.82 | CTSC (0.62) | CTSCKCNH2 | |
| SCHEMBL290107 | 0.80 | CTSC (0.49) | CTSCTSPOKCNH2KMO | |
| SCHEMBL290245 | 0.79 | CTSS (0.39) | POLBL3MBTL1 | |
| SCHEMBL299685 | 0.78 | CTSC (0.49) | CTSCKCNH2 | |
| SCHEMBL288780 | 0.78 | CTSC (0.40) | CTSC | |
| SCHEMBL2885392 | 0.78 | CTSC (0.62) | CTSCKCNH2 | |
| SCHEMBL289727 | 0.76 | CTSC (0.54) | CTSC |
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-2427445-A1 | SUBSTITUTED 1-CYANOETHYLHETEROCYCLYLCARBOXAMIDE COMPOUNDS 750 | AstraZeneca AB (SE) | 2012-03-14 | — | — | EP | disclosed |
| WO-2010128324-A1 | SUBSTITUTED 1-CYANOETHYLHETEROCYCLYLCARBOXAMIDE COMPOUNDS 750 | ASTRAZENECA AB (SE) | 2010-11-11 | — | — | WO | disclosed |