Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 11/20 | 0.55 |
| ▸ | ADORA2A | P29274 | 10/20 | 0.55 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.55 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL12165529 | 0.89 | ADORA3 (0.56) | ADORA3ADORA2AADORA1MEN1ALDH1A1 | |
| SCHEMBL12165501 | 0.89 | ADORA3 (0.54) | ADORA3ADORA2AADORA1 | |
| SCHEMBL12165502 | 0.89 | ADORA3 (0.56) | ADORA3ADORA2AADORA1 | |
| SCHEMBL12165745 | 0.88 | ADORA3 (0.50) | ADORA3ADORA2AADORA1KDM4EMEN1 | |
| SCHEMBL14922233 | 0.87 | ADORA3 (0.52) | ADORA3ADORA2AADORA1 | |
| SCHEMBL16065952 | 0.87 | ADORA3 (0.56) | ADORA3ADORA2AADORA1KDM4EMEN1 | |
| SCHEMBL12188014 | 0.86 | ADORA3 (0.55) | ADORA3ADORA2AADORA1KDM4EMEN1 | |
| SCHEMBL14922472 | 0.85 | ADORA3 (0.50) | ADORA3ADORA2AADORA1 | |
| SCHEMBL12655143 | 0.85 | ADORA3 (0.52) | ADORA3ADORA2AADORA1 | |
| SCHEMBL12165550 | 0.84 | ADORA3 (0.49) | ADORA3ADORA2AADORA1 |
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-2509983-B1 | FUSED TRICYCLIC COMPOUNDS WITH ADENOSINE A2a RECEPTOR ANTAGONIST ACTIVITY | MERCK SHARP & DOHME (US) | 2014-09-17 | — | — | EP | disclosed |