Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 6/20 | 0.59 |
| ▸ | ESRRA | P11474 | 2/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.39 |
| ▸ | PDE4A | P27815 | 3/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | PDE1A | P54750 | 1/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.39 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.39 |
| ▸ | PPARD | Q03181 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8005549 | 0.87 | AR (0.44) | ARESRRAPDE4BPDE4APDE4C | |
| SCHEMBL14748470 | 0.84 | PDE4B (0.40) | ARPDE4BPDE4APDE4CPDE4D | |
| SCHEMBL14470676 | 0.83 | PDE4B (0.53) | PDE4BPDE4APDE4CPDE4DCHRM1 | |
| SCHEMBL14748446 | 0.82 | PTGDR2 (0.45) | ARPDE4BPDE4APDE4CPDE4D | |
| SCHEMBL14748449 | 0.81 | PDE4B (0.38) | ARESRRAPDE4BPDE4APDE4C | |
| SCHEMBL14748410 | 0.81 | ALDH1A1 (0.54) | AR | |
| SCHEMBL14748365 | 0.81 | CYP11B1 (0.49) | ARCYP19A1CYP11B1CYP11B2 | |
| SCHEMBL19622265 | 0.79 | AR (0.36) | ARPDE4BPDE4APDE4CPDE4D | |
| SCHEMBL14748461 | 0.79 | TBXA2R (0.36) | ARPDE4BPDE4APDE4CPDE4D | |
| SCHEMBL8007412 | 0.76 | CYP11B1 (0.44) | SLC6A4HTR2AKCNH2CYP11B1 |
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 3 patents. 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 |
| EP-2564857-A1 | Boron-containing small molecules as anti-inflammatory agents | Anacor Pharmaceuticals, Inc. (US) | 2013-03-06 | — | — | EP | disclosed |
| WO-2009111676-A2 | BORON-CONTAINING SMALL MOLECULES AS ANTI-INFLAMMATORY AGENTS | ANACOR PHARMACEUTICALS, INC (US) | 2009-09-11 | — | — | WO | disclosed |