Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 8/20 | 0.42 |
| ▸ | AR | P10275 | 6/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.35 |
| ▸ | PDE4A | P27815 | 2/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | PDE1A | P54750 | 1/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14748445 | 0.79 | PDE4B (0.44) | PDE4BARPDE4CPDE4DPDE4A | |
| SCHEMBL19622201 | 0.79 | PDE4B (0.48) | PDE4BARPDE4CPDE4DPDE4A | |
| SCHEMBL14748450 | 0.77 | PDE4B (0.44) | PDE4BARPDE4CPDE4DPDE4A | |
| SCHEMBL14748463 | 0.76 | PDE4B (0.47) | PDE4BARPDE4CPDE4DPDE4A | |
| SCHEMBL19622210 | 0.76 | PDE4B (0.44) | PDE4BARPDE4CPDE4DPDE4A | |
| SCHEMBL14748444 | 0.75 | AR (0.39) | PDE4BARPDE4CPDE4DPDE4A | |
| SCHEMBL8004927 | 0.75 | PDE4B (0.56) | PDE4BARPDE4CPDE4DPDE4A | |
| SCHEMBL7997145 | 0.75 | AR (0.45) | PDE4BARPDE4CPDE4DPDE4A | |
| SCHEMBL8007244 | 0.74 | PDE4B (0.42) | PDE4BARPDE4CPDE4DPDE4A | |
| SCHEMBL14748447 | 0.74 | HPGD (0.42) | PDE4BKCNH2 |
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-2564857-A1 | Boron-containing small molecules as anti-inflammatory agents | Anacor Pharmaceuticals, Inc. (US) | 2013-03-06 | — | — | EP | disclosed |