Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 2/20 | 0.40 |
| ▸ | PDE4A | P27815 | 2/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 4/20 | 0.39 |
| ▸ | MAOB | P27338 | 4/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4636762 | 0.90 | MAOB (0.41) | PDE5APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4636001 | 0.85 | MAOA (0.43) | MAPTNPSR1ALDH1A1ALOX12HTT | |
| SCHEMBL2542730 | 0.82 | ADORA2B (0.46) | MAOBADORA2AADORA1 | |
| SCHEMBL4670514 | 0.81 | ADORA2B (0.56) | MAPTALDH1A1HTTTHRBPOLB | |
| SCHEMBL4636158 | 0.79 | ADORA1 (0.48) | PDE4APDE4DADORA3MAOBADORA2A | |
| SCHEMBL4636591 | 0.76 | ADORA1 (0.54) | ADORA3MAOBADORA2AADORA1 | |
| SCHEMBL2542959 | 0.74 | ADORA2A (0.43) | ADORA2AADORA1 | |
| SCHEMBL4636790 | 0.74 | MAOB (0.47) | ALDH1A1POLBMAOAMAOBADORA2A | |
| SCHEMBL4636217 | 0.73 | ADORA3 (0.47) | ALDH1A1HTTADORA3POLBMAOA | |
| SCHEMBL4637264 | 0.72 | MAOB (0.47) | MAPTALDH1A1ADORA3MAOAMAOB |
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-1939197-A1 | 8-ethinylxanthine derivatives as selective A2A receptor antagonists | SCHWARZ PHARMA AG (DE) | 2008-07-02 | — | — | EP | disclosed |