Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.42 |
| ▸ | PAK4 | O96013 | 1/20 | 0.40 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.37 |
| ▸ | VCP | P55072 | 1/20 | 0.37 |
| ▸ | FLT3 | P36888 | 3/20 | 0.35 |
| ▸ | AXL | P30530 | 1/20 | 0.35 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.35 |
| ▸ | MERTK | Q12866 | 1/20 | 0.35 |
| ▸ | GAS6 | Q14393 | 1/20 | 0.35 |
| ▸ | TRIM58 | Q8NG06 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5481000 | 0.88 | HRH4 (0.40) | HRH4PAK4PAK1VCPFLT3 | |
| SCHEMBL5481003 | 0.88 | HRH4 (0.40) | HRH4PAK4PAK1VCPFLT3 | |
| SCHEMBL14442425 | 0.82 | GRIN2B (0.42) | VCPCDK2 | |
| Trifluoroacetic Acid SCHEMBL5481008 | 0.81 | SGK1 (0.45) | HRH4PAK4PAK1VCPFLT3 | |
| Trifluoroacetic Acid SCHEMBL5481009 | 0.81 | SGK1 (0.45) | HRH4PAK4PAK1VCPFLT3 | |
| SCHEMBL8293712 | 0.81 | MAPK8 (0.38) | HRH4PAK4PAK1AURKARPS6KB1 | |
| SCHEMBL8293538 | 0.79 | MAOA (0.36) | AURKARPS6KB1ATAD2CDK2CCNA2 | |
| SCHEMBL8293537 | 0.77 | OGA (0.41) | ROCK2CDK2CCNA2CCNA1 | |
| SCHEMBL8293558 | 0.75 | ALOX5 (0.39) | AURKAVCPCYP3A4CDC7 | |
| SCHEMBL5479121 | 0.75 | KHK (0.37) | HRH4FLT3AXLTYRO3MERTK |
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-2005026159-A1 | BENZOXAZOLE ACETONITRILES | APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) | 2005-03-24 | — | — | WO | disclosed |