Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 14/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 5/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6049613 | 0.93 | ADORA2B (0.41) | ADORA2BADORA2AADORA3ADORA1SMN1; SMN2 | |
| SCHEMBL6049606 | 0.90 | ADORA2B (0.51) | ADORA2BADORA2AADORA3ADORA1 | |
| SCHEMBL5860762 | 0.85 | ADORA3 (0.43) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL6555735 | 0.84 | ADORA2B (0.57) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL6555748 | 0.84 | ADORA2B (0.57) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL17691164 | 0.83 | ADORA2B (0.44) | ADORA2BADORA2AADORA3ADORA1SMN1; SMN2 | |
| SCHEMBL6049598 | 0.83 | ADORA2B (0.44) | ADORA2BADORA2AADORA3ADORA1SMN1; SMN2 | |
| SCHEMBL6049688 | 0.79 | ADORA2B (0.45) | ADORA2BADORA2AADORA3ADORA1 | |
| SCHEMBL6049595 | 0.78 | ADORA2B (0.52) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL6049561 | 0.78 | ADORA2B (0.41) | ADORA2BADORA2AADORA3ADORA1 |
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-1104422-B1 | PHENYL XANTHINE DERIVATIVES | GLAXO GROUP LTD (GB) | 2004-02-18 | — | — | EP | disclosed |