Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 2/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 9/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.37 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.37 |
| ▸ | ACP1 | P24666 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.35 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | UBE2I | P63279 | 2/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.35 |
| ▸ | APBA1 | Q02410 | 2/20 | 0.35 |
| ▸ | SAE1 | Q9UBE0 | 2/20 | 0.35 |
| ▸ | UBA2 | Q9UBT2 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| SCHEMBL2806796 | 1.00 | PDE5A (0.38) | PDE5AADORA3ADORA2BADORA2AADORA1 | |
| SCHEMBL2803607 | 0.82 | PDE5A (0.40) | PDE5AADORA3ADORA2BADORA2AADORA1 | |
| SCHEMBL2803611 | 0.82 | PDE5A (0.40) | PDE5AADORA3ADORA2BADORA2AADORA1 | |
| SCHEMBL2806794 | 0.81 | NR1H4 (0.42) | PDE5AADORA3ADORA2BADORA2AADORA1 | |
| SCHEMBL2803161 | 0.75 | PDE5A (0.47) | PDE5AADORA3ADORA2BADORA2AADORA1 | |
| SCHEMBL13088248 | 0.74 | PDE5A (0.47) | PDE5AADORA3ADORA2BADORA2AADORA1 | |
| SCHEMBL3811994 | 0.72 | PDE5A (0.46) | PDE5AADORA3ADORA2BADORA2AADORA1 | |
| SCHEMBL30772425 | 0.71 | PDE5A (0.41) | PDE5AADORA3ADORA2BADORA2AADORA1 | |
| SCHEMBL2804534 | 0.70 | ACP1 (0.45) | PDE5AADORA3ADORA2AADORA1ACP1 | |
| SCHEMBL13283796 | 0.70 | PDE5A (0.42) | PDE5AADORA3ADORA2BADORA2AADORA1 |
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-2241565-A1 | Aurora kinase inhibitors compounds | Universität Leipzig (DE) | 2010-10-20 | — | — | EP | disclosed |
| WO-2010081881-A1 | AURORA KINASE INHIBITORS COMPOUNDS. | UNIVERSITÄT LEIPZIG (DE) | 2010-07-22 | — | — | WO | disclosed |