Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 11/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 11/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 5/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6038204 | 0.84 | KDM4E (0.38) | ADORA2AADORA1KDM4EALDH1A1HPGD | |
| SCHEMBL6038192 | 0.79 | MAPT (0.44) | ADORA2AADORA1KDM4EALDH1A1HPGD | |
| SCHEMBL5016298 | 0.78 | ADORA2A (0.61) | ADORA2AADORA1KDM4EALDH1A1HPGD | |
| SCHEMBL6038277 | 0.76 | ADORA2A (0.46) | ADORA2AADORA1KDM4EALDH1A1HPGD | |
| SCHEMBL27681226 | 0.76 | ADORA2A (0.53) | ADORA2AADORA1KDM4EALDH1A1HPGD | |
| SCHEMBL5017683 | 0.75 | ADORA2A (0.67) | ADORA2AADORA1KDM4EALDH1A1HPGD | |
| SCHEMBL5022577 | 0.74 | ADORA2A (0.65) | ADORA2AADORA1KDM4EALDH1A1HPGD | |
| SCHEMBL27681228 | 0.73 | ADORA2A (0.51) | ADORA2AADORA1KDM4EALDH1A1HPGD | |
| SCHEMBL6038275 | 0.72 | ADORA2A (0.64) | ADORA2AADORA1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL5017767 | 0.72 | ADORA2A (0.50) | ADORA2AADORA1KDM4EALDH1A1HPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1697351-A1 | 2,6-BISHETEROARYL-4-AMINOPYRIMIDINES AS ADENOSINE RECEPTOR ANTAGONISTS | Almirall Prodesfarma AG (CH) | 2006-09-06 | — | — | EP | disclosed |
| WO-2005058883-A1 | 2, 6 BISHETEROARYL-4-AMINOPYRIMIDINES AS ADENOSINE RECEPTOR ANTAGONISTS | ALMIRALL PRODESFARMA AG (CH) | 2005-06-30 | — | — | WO | disclosed |