Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 17/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.53 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.53 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27992045 | 0.91 | ADORA2A (0.58) | ADORA2AADORA3ADORA2BADORA1HTT | |
| SCHEMBL2553742 | 0.79 | ADORA2A (0.58) | ADORA2AADORA3ADORA2BADORA1HTT | |
| SCHEMBL2549250 | 0.76 | ADORA2A (0.56) | ADORA2AADORA3ADORA2BADORA1HTT | |
| SCHEMBL28042559 | 0.75 | PDE10A (0.58) | ADORA2AADORA1LMNAPDE10AMAPT | |
| SCHEMBL2547816 | 0.74 | ADORA2A (0.80) | ADORA2AADORA3ADORA2BADORA1HTT | |
| SCHEMBL2541912 | 0.74 | ADORA2A (0.59) | ADORA2AADORA3ADORA2BADORA1HTT | |
| SCHEMBL14672427 | 0.74 | ADORA2A (0.67) | ADORA2AADORA3ADORA2BADORA1PDE10A | |
| SCHEMBL2550277 | 0.73 | ADORA2A (0.62) | ADORA2AADORA3ADORA2BADORA1HTT | |
| SCHEMBL28042565 | 0.73 | ADORA2A (0.50) | ADORA2AADORA3ADORA2BADORA1HTT | |
| SCHEMBL28870957 | 0.71 | HTT (0.62) | ADORA2AADORA3ADORA2BADORA1HTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011121418-A1 | 4 - AMINOPYRIMIDINE DERIVATIVES AND THEIR AS AS ADENOSINE A2A RECEPTOR ANTAGONISTS | PALOBIOFARMA, S.L. (ES) | 2011-10-06 | — | — | WO | claimed |
| CN-102892761-B | 4 - aminopyrimidine derivatives and their as as adenosine a2a receptor antagonists | PALOBIOFARMA SL | 2015-02-04 | — | — | CN | disclosed |
| WO-2011121418-A1 | 4 - AMINOPYRIMIDINE DERIVATIVES AND THEIR AS AS ADENOSINE A2A RECEPTOR ANTAGONISTS | PALOBIOFARMA, S.L. (ES) | 2011-10-06 | — | — | WO | disclosed |