Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 3/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.33 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.33 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.33 |
| ▸ | TAS2R8 | Q9NYW2 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL4763171 | 1.00 | ADORA2B (0.43) | ADORA2BADORA1ADORA2AALDH1A1MAPK1 | |
| SCHEMBL4764008 | 0.93 | ADORA2B (0.41) | ADORA2BADORA1ADORA2AALDH1A1MAPK1 | |
| SCHEMBL4764018 | 0.93 | ADORA2B (0.41) | ADORA2BADORA1ADORA2AALDH1A1MAPK1 | |
| SCHEMBL4765708 | 0.90 | TP53 (0.41) | ADORA2BADORA1ADORA2AALDH1A1MAPT | |
| SCHEMBL4765722 | 0.90 | TP53 (0.41) | ADORA2BADORA1ADORA2AALDH1A1MAPT | |
| SCHEMBL4766007 | 0.89 | C5AR1 (0.41) | ADORA2BADORA1ADORA2AC5AR1 | |
| SCHEMBL4770754 | 0.89 | ADORA2B (0.48) | ADORA2BADORA1ADORA2AALDH1A1MAPK1 | |
| SCHEMBL4770747 | 0.89 | ADORA2B (0.48) | ADORA2BADORA1ADORA2AALDH1A1MAPK1 | |
| SCHEMBL4763384 | 0.88 | ADORA2B (0.44) | ADORA2BADORA1ADORA2AALDH1A1MAPK1 | |
| SCHEMBL4769673 | 0.87 | ADORA2B (0.52) | ADORA2BADORA1ADORA2AADORA3 |
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-1678181-B1 | A2B ADENOSINE RECEPTOR ANTAGONISTS | CV THERAPEUTICS INC (US) | 2008-12-31 | — | — | EP | disclosed |