Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 5/20 | 0.38 |
| ▸ | PDE4A | P27815 | 3/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | PDE1A | P54750 | 1/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 2/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 10/20 | 0.32 |
| ▸ | ESRRA | P11474 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL14748470 | 0.82 | PDE4B (0.40) | PDE4BPDE4APDE4CPDE4DCHRM1 | |
| SCHEMBL8005549 | 0.82 | AR (0.44) | PDE4BPDE4APDE4CPDE4DCHRM1 | |
| SCHEMBL8005546 | 0.81 | AR (0.59) | PDE4BPDE4APDE4CPDE4DCHRM1 | |
| SCHEMBL14470676 | 0.81 | PDE4B (0.53) | PDE4BPDE4APDE4CPDE4DCHRM1 | |
| SCHEMBL19622265 | 0.79 | AR (0.36) | PDE4BPDE4APDE4CPDE4DCHRM1 | |
| SCHEMBL14748446 | 0.78 | PTGDR2 (0.45) | PDE4BPDE4APDE4CPDE4DCHRM1 | |
| SCHEMBL2525570 | 0.76 | PDE4B (0.67) | PDE4BPDE4APDE4CPDE4DCHRM1 | |
| SCHEMBL15787124 | 0.75 | TBXA2R (0.47) | ARTBXA2RALDH1A1LMNACYP1A2 | |
| SCHEMBL8007412 | 0.74 | CYP11B1 (0.44) | HTR2ASLC6A4KCNH2ALDH1A1 | |
| SCHEMBL8004927 | 0.73 | PDE4B (0.56) | PDE4BPDE4APDE4CPDE4DAR |
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 2 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 |