Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 7/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6049595 | 0.92 | ADORA2B (0.52) | ADORA2BADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL6554030 | 0.87 | ADORA2B (0.43) | ADORA2BADORA3ADORA2AADORA1GLA | |
| SCHEMBL6049659 | 0.87 | ADORA2B (0.43) | ADORA2BADORA3ADORA2AADORA1HDAC1 | |
| SCHEMBL17691164 | 0.85 | ADORA2B (0.44) | ADORA2BADORA3ADORA2AADORA1HDAC1 | |
| SCHEMBL6049598 | 0.85 | ADORA2B (0.44) | ADORA2BADORA3ADORA2AADORA1HDAC1 | |
| SCHEMBL6553594 | 0.84 | ADORA2B (0.40) | ADORA2BADORA3ADORA2AADORA1ALDH1A1 | |
| SCHEMBL6553578 | 0.84 | ADORA2B (0.60) | ADORA2BADORA3ADORA2AADORA1HDAC1 | |
| SCHEMBL6553587 | 0.84 | ADORA2B (0.60) | ADORA2BADORA3ADORA2AADORA1HDAC1 | |
| SCHEMBL6049631 | 0.84 | ADORA2B (0.45) | ADORA2BADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL6049606 | 0.83 | ADORA2B (0.51) | ADORA2BADORA3ADORA2AADORA1 |
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 |