Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 4/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 4/20 | 0.35 |
| ▸ | FPR2 | P25090 | 1/20 | 0.35 |
| ▸ | SCN7A | Q01118 | 3/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.32 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 2/20 | 0.32 |
| ▸ | PPARA | Q07869 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | PDE1A | P54750 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 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 | |
|---|---|---|---|---|
| SCHEMBL8004246 | 0.81 | PDE4B (0.58) | PDE4BHRH3SCN9AFPR2SCN7A | |
| SCHEMBL19622217 | 0.80 | FGFR1 (0.39) | — | |
| SCHEMBL8010823 | 0.79 | PDE4B (0.42) | PDE4BHRH3SCN9AFPR2OPRM1 | |
| SCHEMBL19622216 | 0.77 | ACHE (0.36) | — | |
| SCHEMBL14748446 | 0.74 | PTGDR2 (0.45) | PDE4BPPARDPPARACHRM1PDE4A | |
| SCHEMBL14748461 | 0.73 | TBXA2R (0.36) | PDE4BPPARDPPARACHRM1PDE4A | |
| SCHEMBL8005546 | 0.72 | AR (0.59) | PDE4BKCNH2PPARDPPARACHRM1 | |
| SCHEMBL19622265 | 0.72 | AR (0.36) | PDE4BSCN9APPARDPPARACHRM1 | |
| SCHEMBL8005549 | 0.71 | AR (0.44) | PDE4BKCNH2CHRM1PDE4AADRA1A | |
| SCHEMBL7862450 | 0.70 | PDE4B (0.43) | PDE4BPDE4APDE4CPDE4D |
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 |