Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 13/20 | 0.47 |
| ▸ | CTSK | P43235 | 6/20 | 0.47 |
| ▸ | SDCBP | O00560 | 1/20 | 0.38 |
| ▸ | SDC2 | P34741 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.31 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.31 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.31 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL299705 | 0.81 | CTSC (0.51) | CTSCCTSKSDCBPSDC2PIK3CA | |
| SCHEMBL2890645 | 0.78 | CTSC (0.68) | CTSCCTSKKCNH2LTB4RLTB4R2 | |
| SCHEMBL290586 | 0.78 | CTSC (0.34) | CTSCKCNH2LTB4RLTB4R2 | |
| SCHEMBL289267 | 0.78 | CTSC (0.43) | CTSCCTSKSDCBPSDC2PIK3CA | |
| SCHEMBL300375 | 0.77 | CTSC (0.34) | CTSCKCNH2LTB4RLTB4R2 | |
| SCHEMBL298896 | 0.74 | CTSC (0.59) | CTSCCTSKSDCBPSDC2 | |
| SCHEMBL2892971 | 0.71 | CTSC (0.48) | CTSCCTSKSDCBPSDC2 | |
| SCHEMBL2892969 | 0.71 | CTSC (0.48) | CTSCCTSKSDCBPSDC2 | |
| SCHEMBL289735 | 0.71 | CTSC (0.87) | CTSCCTSKKCNH2LTB4RLTB4R2 | |
| SCHEMBL289736 | 0.71 | CTSC (0.87) | CTSCCTSKKCNH2LTB4RLTB4R2 |
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 |