Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 1/20 | 0.56 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.45 |
| ▸ | SUV39H2 | Q9H5I1 | 2/20 | 0.44 |
| ▸ | CTSB | P07858 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | PANK3 | Q9H999 | 5/20 | 0.41 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4573828 | 1.00 | MAP4K4 (0.56) | MAP4K4HDAC1GPR119SUV39H2CTSB | |
| SCHEMBL4574046 | 0.86 | MAP4K4 (0.59) | MAP4K4HDAC1GPR119SUV39H2CTSB | |
| SCHEMBL8097015 | 0.86 | MAP4K4 (0.59) | MAP4K4HDAC1GPR119SUV39H2CTSB | |
| SCHEMBL4573074 | 0.86 | CTSB (0.45) | MAP4K4CTSBCTSSCTSKPANK3 | |
| SCHEMBL4573301 | 0.85 | MAP4K4 (0.58) | MAP4K4HDAC1GPR119SUV39H2CTSB | |
| SCHEMBL8117492 | 0.85 | MAP4K4 (0.58) | MAP4K4HDAC1GPR119SUV39H2CTSB | |
| SCHEMBL8108991 | 0.85 | GPR119 (0.51) | MAP4K4HDAC1GPR119SUV39H2CHRM4 | |
| SCHEMBL4573572 | 0.85 | GPR119 (0.51) | MAP4K4HDAC1GPR119SUV39H2CHRM4 | |
| SCHEMBL16333441 | 0.84 | MAP4K4 (0.57) | MAP4K4HDAC1GPR119SUV39H2CTSB | |
| SCHEMBL4573681 | 0.84 | MAP4K4 (0.51) | MAP4K4GPR119SUV39H2 |
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 |