Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 14/20 | 0.53 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.50 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | ABL1 | P00519 | 1/20 | 0.42 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.42 |
| ▸ | UBE2I | P63279 | 1/20 | 0.41 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.41 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.41 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8990766 | 0.89 | ADORA2A (0.41) | ADORA2AADORA1ADORA3ADORA2BHPGD | |
| SCHEMBL8990654 | 0.88 | ALDH1A1 (0.45) | ADORA2AADORA1ADORA3ADORA2BHPGD | |
| SCHEMBL8990683 | 0.88 | ADORA2A (0.52) | ADORA2AADORA1ADORA3ADORA2BHPGD | |
| SCHEMBL7149748 | 0.73 | ADORA2A (0.53) | ADORA2AADORA1ADORA3ADORA2BHPGD | |
| SCHEMBL7145246 | 0.71 | ADORA2A (0.52) | ADORA2AADORA1ADORA3ADORA2BHPGD | |
| SCHEMBL7144746 | 0.71 | ADORA2A (0.53) | ADORA2AADORA1ADORA3ADORA2BHPGD | |
| SCHEMBL7169942 | 0.71 | ADORA2A (0.52) | ADORA2AADORA1ADORA3ADORA2BHPGD | |
| SCHEMBL5044568 | 0.69 | ALDH1A1 (0.57) | ADORA2AADORA1ADORA3ADORA2BHPGD | |
| SCHEMBL5016166 | 0.67 | ADORA2A (0.58) | ADORA2AADORA1ADORA3ADORA2BHPGD | |
| SCHEMBL7145041 | 0.67 | ADORA2A (0.56) | ADORA2AADORA1ADORA3ADORA2BHPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5500428-A | Furyl-substituted purines and adenosine antagonists | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1996-03-19 | — | — | US | disclosed |
| US-5300509-A | Adenosine antagonists for treating cardiovascular disorders, vasodilation | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1994-04-05 | — | — | US | disclosed |
| EP-0544445-A2 | Furyl-substituted purines, oxazolopyrimidines and pteridines as adenosine antagonists | ZENECA LIMITED (GB) | 1993-06-02 | — | — | EP | disclosed |