Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 12/20 | 0.54 |
| ▸ | ADORA1 | P30542 | 11/20 | 0.54 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.54 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.54 |
| ▸ | PDE4A | P27815 | 6/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 6/20 | 0.49 |
| ▸ | PDE4C | Q08493 | 6/20 | 0.49 |
| ▸ | PDE4D | Q08499 | 6/20 | 0.49 |
| ▸ | PDE3B | Q13370 | 5/20 | 0.49 |
| ▸ | PDE3A | Q14432 | 5/20 | 0.49 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14513332 | 0.90 | ADORA2A (0.51) | ADORA2AADORA1ADORA2BADORA3PDE4A | |
| SCHEMBL3679965 | 0.79 | ADORA2A (0.77) | ADORA2AADORA1ADORA2BADORA3PDE4A | |
| SCHEMBL4715461 | 0.77 | ADORA2A (0.62) | ADORA2AADORA1ADORA2BADORA3PDE4A | |
| SCHEMBL10171315 | 0.77 | ADORA2A (0.58) | ADORA2AADORA1ADORA2BADORA3PDE4A | |
| SCHEMBL179279 | 0.77 | ADORA2A (0.44) | ADORA2AADORA1ADORA2BADORA3PDE7A | |
| SCHEMBL24995357 | 0.77 | ADORA2A (0.60) | ADORA2AADORA1ADORA2BADORA3PDE4A | |
| SCHEMBL10139170 | 0.77 | ADORA2A (0.58) | ADORA2AADORA1ADORA2BADORA3PDE7A | |
| SCHEMBL19261286 | 0.76 | ADORA2A (0.42) | ADORA2AADORA1ADORA2BADORA3PDE7A | |
| SCHEMBL9381944 | 0.76 | ADORA2A (0.56) | ADORA2AADORA1ADORA2BADORA3PDE4A | |
| SCHEMBL8363046 | 0.76 | ADORA2A (0.42) | ADORA2AADORA1ADORA2BADORA3PDE7A |
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 |
|---|---|---|---|---|---|---|---|
| US-7601713-B2 | Kinase inhibitors and their uses | RIGEL PHARMACEUTICALS, INC. (US) | 2009-10-13 | — | — | US | disclosed |