Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4064165 | 0.70 | HRH3 (0.38) | ADORA2AADORA1SMN1; SMN2 | |
| SCHEMBL8053837 | 0.69 | RPS6KB1 (0.47) | — | |
| SCHEMBL4572174 | 0.67 | LRRK2 (0.39) | SMN1; SMN2 | |
| SCHEMBL239202 | 0.67 | PDE1B (0.40) | ADORA2ASMN1; SMN2 | |
| SCHEMBL14780097 | 0.67 | CDK2 (0.52) | ADORA2AADORA1SMN1; SMN2 | |
| SCHEMBL239850 | 0.66 | TP53 (0.41) | SMN1; SMN2 | |
| SCHEMBL4572190 | 0.66 | LRRK2 (0.38) | SMN1; SMN2 | |
| SCHEMBL240657 | 0.66 | TP53 (0.41) | SMN1; SMN2 | |
| SCHEMBL14779312 | 0.65 | CSF1R (0.53) | ADORA2AADORA1SMN1; SMN2 | |
| SCHEMBL8565 | 0.65 | ADORA2A (0.58) | ADORA2AADORA1 |
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-1812003-A1 | ORTHO- CONDENSED PYRIDINE AND PYRIMIDINE DERIVATIVES (E. G. PURINES) AS PROTEIN KINASES INHIBITORS | Astex Therapeutics Limited (GB) | 2007-08-01 | — | — | EP | disclosed |
| WO-2006046023-A1 | ORTHO- CONDENSED PYRIDINE AND PYRIMIDINE DERIVATIVES (E. G. PURINES) AS PROTEIN KINASES INHIBITORS | ASTEX THERAPEUTICS LIMITED (GB) | 2006-05-04 | — | — | WO | disclosed |