Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 7/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.39 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.36 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | PKM | P14618 | 3/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | PKLR | P30613 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL4763211 | 0.92 | ADORA2B (0.42) | ADORA2BADORA2AADORA1NCOA1NCOA3 | |
| SCHEMBL4771427 | 0.91 | ADORA2B (0.41) | ADORA2BADORA2AADORA1NCOA1NCOA3 | |
| SCHEMBL4766145 | 0.91 | ADORA2B (0.41) | ADORA2BADORA2AADORA1NCOA1NCOA3 | |
| SCHEMBL4763491 | 0.90 | ADORA2B (0.42) | ADORA2BADORA2AADORA1NCOA1NCOA3 | |
| SCHEMBL4763488 | 0.90 | ADORA2B (0.42) | ADORA2BADORA2AADORA1NCOA1NCOA3 | |
| SCHEMBL4767707 | 0.90 | ADORA2B (0.46) | ADORA2BADORA2AADORA1NCOA1NCOA3 | |
| SCHEMBL4763889 | 0.89 | ADORA2B (0.46) | ADORA2BADORA2AADORA1NCOA1NCOA3 | |
| SCHEMBL4763896 | 0.89 | ADORA2B (0.46) | ADORA2BADORA2AADORA1NCOA1NCOA3 | |
| SCHEMBL4769328 | 0.87 | ADORA2B (0.49) | ADORA2BADORA2AADORA1NCOA1NCOA3 | |
| SCHEMBL4769321 | 0.87 | ADORA2B (0.49) | ADORA2BADORA2AADORA1NCOA1NCOA3 |
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 |