Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 14/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL290107 | 0.96 | CTSC (0.49) | CTSCKCNH2SMN1; SMN2 | |
| SCHEMBL290320 | 0.87 | CTSC (0.45) | CTSCKCNH2 | |
| SCHEMBL2885392 | 0.86 | CTSC (0.62) | CTSCKCNH2 | |
| SCHEMBL290293 | 0.82 | CTSC (0.50) | CTSCKCNH2 | |
| SCHEMBL2890775 | 0.82 | CTSC (0.62) | CTSCKCNH2 | |
| SCHEMBL290462 | 0.80 | CTSC (0.46) | CTSCKCNH2MEN1NPC1TSHR | |
| SCHEMBL299037 | 0.80 | CTSC (0.49) | CTSCKCNH2MEN1NPC1TSHR | |
| SCHEMBL7871687 | 0.78 | CTSC (0.59) | CTSCKCNH2 | |
| SCHEMBL16478129 | 0.78 | CTSC (0.52) | CTSCKCNH2ASAH1MAPT | |
| SCHEMBL16478115 | 0.78 | CTSC (0.49) | CTSCKCNH2ASAH1 |
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 |