Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 18/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 11/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | XBP1 | P17861 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5016126 | 0.78 | ADORA2A (0.51) | ADORA2AADORA1CYP3A4SMN1; SMN2MEN1 | |
| SCHEMBL5016104 | 0.76 | ADORA2A (0.59) | ADORA2AADORA1CYP3A4 | |
| SCHEMBL6038299 | 0.72 | CYP3A4 (0.51) | ADORA2AADORA1CYP3A4MEN1MAPT | |
| SCHEMBL5022548 | 0.70 | ADORA2A (0.75) | ADORA2AADORA1CYP3A4 | |
| SCHEMBL4664166 | 0.66 | P2RX7 (0.46) | SMN1; SMN2MEN1KMT2ANPSR1RAB9A | |
| Dipyridyl SCHEMBL28175116 | 0.66 | KDM4E (0.50) | SMN1; SMN2MAPK1NPSR1L3MBTL1NPC1 | |
| SCHEMBL626826 | 0.66 | HRH1 (0.57) | SMN1; SMN2MAPK1NPC1RAB9A | |
| SCHEMBL10423638 | 0.65 | CCR1 (0.46) | L3MBTL1 | |
| SCHEMBL2812733 | 0.65 | ADORA2A (0.69) | ADORA2AADORA1CYP3A4 | |
| SCHEMBL15761678 | 0.64 | MAPT (0.71) | ADORA2AADORA1CYP3A4SMN1; SMN2MEN1 |
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 |