Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 5/20 | 0.44 |
| ▸ | AR | P10275 | 10/20 | 0.41 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.39 |
| ▸ | ESRRA | P11474 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 2/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | PDE1A | P54750 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19622296 | 0.83 | AR (0.48) | PDE4BARSLC22A12 | |
| SCHEMBL2531105 | 0.75 | PDE4B (0.79) | PDE4BPDE4APDE4CPDE4DCHRM1 | |
| SCHEMBL13890548 | 0.73 | AR (0.53) | PDE4BARPDE4APDE4CPDE4D | |
| SCHEMBL17623897 | 0.73 | AR (0.53) | ARMRGPRX4 | |
| SCHEMBL1656135 | 0.72 | PDE4B (0.51) | PDE4BAR | |
| SCHEMBL4377219 | 0.72 | AR (0.53) | ARSLC22A12 | |
| SCHEMBL509379 | 0.69 | AR (0.50) | ARMRGPRX4 | |
| SCHEMBL25865448 | 0.69 | AR (0.48) | ARMRGPRX4 | |
| SCHEMBL13890508 | 0.68 | AR (0.66) | PDE4BARSLC22A12PDE4APDE4C | |
| SCHEMBL25680960 | 0.68 | AR (0.44) | ARSLC22A12ESRRAMRGPRX4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3246034-A1 | BORON-CONTAINING SMALL MOLECULES AS ANTI-INFLAMMATORY AGENTS | Anacor Pharmaceuticals, Inc. (US) | 2017-11-22 | — | — | EP | disclosed |