Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 2/20 | 0.32 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | CTSS | P25774 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.31 |
| ▸ | EPAS1 | Q99814 | 2/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.30 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL290023 | 0.86 | CTSC (0.45) | CTSCKCNH2LTB4RLTB4R2 | |
| SCHEMBL288985 | 0.86 | MMP1 (0.41) | CTSCCTSBCTSSKCNH2LTB4R | |
| SCHEMBL290245 | 0.84 | CTSS (0.39) | CTSS | |
| SCHEMBL290153 | 0.84 | CD274 (0.35) | CTSCHIF1AEPAS1KCNH2LTB4R | |
| SCHEMBL289589 | 0.82 | RORC (0.37) | CTSC | |
| SCHEMBL290311 | 0.81 | MMP12 (0.44) | CTSCKCNH2LTB4RLTB4R2 | |
| SCHEMBL290665 | 0.81 | CTSC (0.34) | CTSCKCNH2LTB4RLTB4R2 | |
| SCHEMBL290265 | 0.81 | CTSC (0.34) | CTSCCTSBCTSSKCNH2LTB4R | |
| SCHEMBL290431 | 0.80 | GAA (0.48) | KCNH2 | |
| SCHEMBL299846 | 0.80 | MMP1 (0.35) | CTSCKCNH2LTB4RLTB4R2 |
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 |