Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RET | P07949 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 8/20 | 0.35 |
| ▸ | CTSK | P43235 | 4/20 | 0.35 |
| ▸ | CTSC | P53634 | 5/20 | 0.35 |
| ▸ | CTSL | P07711 | 7/20 | 0.34 |
| ▸ | CTSB | P07858 | 7/20 | 0.34 |
| ▸ | CTSF | Q9UBX1 | 2/20 | 0.34 |
| ▸ | CTSV | O60911 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 2/20 | 0.33 |
| ▸ | MMP13 | P45452 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.33 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.33 |
| ▸ | GHSR | Q92847 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL289590 | 0.88 | CTSC (0.38) | CTSSCTSKCTSCCTSLCTSB | |
| SCHEMBL290038 | 0.86 | RET (0.37) | RETCTSSCTSKCTSCCTSL | |
| SCHEMBL2890536 | 0.84 | CTSC (0.50) | RETCTSSCTSKCTSCCTSL | |
| SCHEMBL2890537 | 0.84 | CTSC (0.50) | RETCTSSCTSKCTSCCTSL | |
| SCHEMBL299918 | 0.79 | CTSC (0.48) | RETCTSSCTSKCTSCCTSL | |
| SCHEMBL16478185 | 0.78 | RET (0.40) | RETCTSKCTSC | |
| SCHEMBL290711 | 0.77 | RET (0.37) | RETCTSSCTSKCTSCCTSL | |
| SCHEMBL2892835 | 0.76 | ITGB1 (0.41) | CTSSCTSKCTSC | |
| SCHEMBL2892834 | 0.76 | ITGB1 (0.41) | CTSSCTSKCTSC | |
| SCHEMBL16485747 | 0.75 | CTSC (0.49) | CTSSCTSKCTSCCTSLCTSB |
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 |