Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.42 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.36 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.33 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.33 |
| ▸ | KDM5A | P29375 | 1/20 | 0.33 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | MTOR | P42345 | 1/20 | 0.30 |
| ▸ | HRH4 | Q9H3N8 | 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 | |
|---|---|---|---|---|
| SCHEMBL2190316 | 0.78 | ADORA1 (0.53) | ADORA2AADORA1LRRK2CYP2C9CYP2C19 | |
| SCHEMBL2185605 | 0.69 | ADORA2A (0.46) | ADORA2AADORA1LRRK2CYP2C9CYP2C19 | |
| SCHEMBL2188560 | 0.69 | ADORA1 (0.58) | ADORA2AADORA1ADORA3HRH4 | |
| SCHEMBL2190600 | 0.68 | CYP2C9 (0.42) | ADORA2AADORA1LRRK2CYP2C9CYP2C19 | |
| SCHEMBL16547507 | 0.67 | CYP2C9 (0.52) | ADORA2AADORA1LRRK2CYP2C9CYP2C19 | |
| SCHEMBL2184224 | 0.67 | ADORA2A (0.47) | ADORA2AADORA1LRRK2CYP2C9CYP2C19 | |
| SCHEMBL2187983 | 0.67 | ADORA2A (0.56) | ADORA2AADORA1LRRK2CYP2C9CYP2C19 | |
| SCHEMBL28637477 | 0.66 | ADORA2A (0.53) | ADORA2AADORA1ADORA3MAPT | |
| SCHEMBL22055303 | 0.65 | ADORA2A (0.63) | ADORA2AADORA1ADORA3 | |
| SCHEMBL2187562 | 0.65 | LRRK2 (0.42) | ADORA2AADORA1LRRK2CYP2C9CYP2C19 |
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-2346859-A1 | HETEROCYCLIC JAK KINASE INHIBITORS | AstraZeneca AB (SE) | 2011-07-27 | — | — | EP | disclosed |