Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9904076 | 0.90 | ADORA2B (0.37) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL9904219 | 0.80 | EEF2K (0.34) | ADORA2AMEN1KMT2AADORA2B | |
| SCHEMBL9943417 | 0.70 | EPHX2 (0.35) | MEN1ALDH1A1KMT2A | |
| SCHEMBL2328928 | 0.65 | MAPT (0.47) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL1866393 | 0.62 | ADORA2B (0.44) | ADORA2AMEN1ALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL12079923 | 0.61 | ADORA1 (0.52) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL1944878 | 0.60 | MAPT (0.42) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL3447830 | 0.59 | MAPT (0.42) | ADORA2APOLBMAPTMEN1ALDH1A1 | |
| SCHEMBL15780384 | 0.57 | MAPT (0.46) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| SCHEMBL7093037 | 0.56 | MAPT (0.49) | POLBMAPTMEN1ALDH1A1KMT2A |
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-2465859-A1 | 8-Triazolylxanthine derivatives, processes for their production and their use as adenosine receptor antagonists | Life & Brain GmbH (DE) | 2012-06-20 | — | — | EP | disclosed |