Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 2/20 | 0.42 |
| ▸ | CTSS | P25774 | 2/20 | 0.42 |
| ▸ | CTSK | P43235 | 2/20 | 0.42 |
| ▸ | GRM1 | Q13255 | 6/20 | 0.40 |
| ▸ | PANK3 | Q9H999 | 4/20 | 0.39 |
| ▸ | TRPC6 | Q9Y210 | 7/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8107805 | 0.86 | HDAC1 (0.49) | CTSBCTSSCTSKGRM1PANK3 | |
| SCHEMBL4573147 | 0.84 | GRM1 (0.39) | CTSBCTSSCTSKGRM1ROCK2 | |
| SCHEMBL4572967 | 0.78 | CHRM4 (0.46) | GRM1 | |
| SCHEMBL4573074 | 0.76 | CTSB (0.45) | CTSBCTSSCTSKGRM1PANK3 | |
| SCHEMBL4573182 | 0.76 | PIK3CD (0.41) | CTSBCTSSCTSKGRM1 | |
| SCHEMBL8123583 | 0.75 | ZAP70 (0.45) | TRPC6 | |
| SCHEMBL4573061 | 0.74 | ROCK2 (0.48) | GRM1ROCK2PRKG1 | |
| SCHEMBL16334066 | 0.72 | HDAC1 (0.49) | GRM1ROCK2PRKG1 | |
| SCHEMBL24890694 | 0.71 | NPC1 (0.61) | GRM1 | |
| SCHEMBL4573206 | 0.71 | PIK3CD (0.38) | GRM1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009001127-A1 | CYANOCYCLOPROPYLCARBOXAMIDES AS CATHEPSIN INHIBITORS | ASTRAZENECA AB (SE) | 2008-12-31 | — | — | WO | disclosed |