Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 6/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.40 |
| ▸ | L3MBTL3 | Q96JM7 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.40 |
| ▸ | ACACB | O00763 | 2/20 | 0.40 |
| ▸ | ACACA | Q13085 | 2/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.39 |
| ▸ | MTOR | P42345 | 2/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.39 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.39 |
| ▸ | ATR | Q13535 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3171802 | 0.93 | ADORA2A (0.41) | ADORA2AADORA1ADORA3ACACBACACA | |
| SCHEMBL3161815 | 0.92 | ADORA2A (0.42) | ADORA2AADORA1ADORA3ACACBACACA | |
| SCHEMBL3162937 | 0.91 | ADORA2A (0.46) | ADORA2AADORA1ADORA3ADORA2BTSHR | |
| SCHEMBL3166225 | 0.90 | ADORA2A (0.45) | ADORA2AADORA1ADORA3ADORA2BTSHR | |
| SCHEMBL3174594 | 0.90 | ADORA2A (0.45) | ADORA2AADORA1ADORA3ADORA2BTSHR | |
| SCHEMBL3169774 | 0.89 | ADORA2A (0.43) | ADORA2AADORA1ADORA3ADORA2BTSHR | |
| SCHEMBL3163481 | 0.88 | ADORA2A (0.41) | ADORA2AADORA1ADORA3ADORA2BTSHR | |
| SCHEMBL3165495 | 0.87 | TDP1 (0.45) | ADORA2AADORA1ADORA3ADORA2BTSHR | |
| SCHEMBL3175769 | 0.86 | ADORA2A (0.45) | ADORA2AADORA1ADORA3ADORA2BTSHR | |
| SCHEMBL3172373 | 0.86 | GRIN2D (0.49) | ADORA2AADORA1L3MBTL1ADORA3ADORA2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-1465631-B1 | PYRIMIDINE A2B SELECTIVE ANTAGONIST COMPOUNDS, THEIR SYNTHESIS AND USE | OSI PHARM INC (US) | 2010-02-24 | — | — | EP | disclosed |