Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | TDO2 | P48775 | 1/20 | 0.41 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | IDH2 | P48735 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.32 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | SCD | O00767 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2556805 | 0.94 | EGLN1 (0.44) | KDM4EMAPTMAPK1NPSR1L3MBTL1 | |
| SCHEMBL14672678 | 0.74 | ADORA2A (0.62) | KDM4EMAPTMAPK1NPSR1L3MBTL1 | |
| SCHEMBL2547017 | 0.73 | ADORA2A (0.53) | KDM4EMAPTMAPK1NPSR1L3MBTL1 | |
| SCHEMBL2576944 | 0.72 | KMT2A (0.45) | KDM4EMAPTMAPK1NPSR1L3MBTL1 | |
| SCHEMBL14717394 | 0.72 | ADORA2A (0.63) | KDM4EMAPTMAPK1NPSR1L3MBTL1 | |
| SCHEMBL14672677 | 0.72 | ADORA2A (0.63) | KDM4EMAPTMAPK1NPSR1L3MBTL1 | |
| SCHEMBL2547620 | 0.71 | ADORA2A (0.56) | MAPTMAPK1NPSR1L3MBTL1PDE10A | |
| SCHEMBL2551256 | 0.70 | ADORA2A (0.47) | KDM4EMAPTMAPK1NPSR1L3MBTL1 | |
| SCHEMBL2554675 | 0.70 | ADORA2A (0.47) | KDM4EMAPTMAPK1NPSR1L3MBTL1 | |
| SCHEMBL2546203 | 0.70 | ADORA2A (0.60) | KDM4EMAPTMAPK1NPSR1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011121418-A1 | 4 - AMINOPYRIMIDINE DERIVATIVES AND THEIR AS AS ADENOSINE A2A RECEPTOR ANTAGONISTS | PALOBIOFARMA, S.L. (ES) | 2011-10-06 | — | — | WO | disclosed |