Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 18/20 | 0.71 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL245503 | 0.93 | ADORA1 (0.72) | ADORA1ADORA2B | |
| SCHEMBL254320 | 0.91 | ADORA1 (0.70) | ADORA1ADORA2BADORA3KDM4EMEN1 | |
| SCHEMBL3361524 | 0.86 | ADORA1 (0.65) | ADORA1ADORA2BADORA3KDM4EMEN1 | |
| SCHEMBL244063 | 0.85 | ADORA1 (0.77) | ADORA1ADORA2BKDM4EMEN1USP2 | |
| SCHEMBL244025 | 0.85 | ADORA1 (0.70) | ADORA1ADORA2B | |
| SCHEMBL12503198 | 0.83 | ADORA1 (0.67) | ADORA1ADORA2BKDM4EMEN1USP2 | |
| SCHEMBL244759 | 0.83 | ADORA1 (1.00) | ADORA1ADORA2BADORA3KDM4EMEN1 | |
| SCHEMBL3337662 | 0.83 | ADORA1 (1.00) | ADORA1ADORA2BADORA3KDM4EMEN1 | |
| SCHEMBL382292 | 0.82 | ADORA1 (0.76) | ADORA1ADORA2BADORA3KDM4EMEN1 | |
| SCHEMBL244002 | 0.80 | ADORA1 (0.79) | ADORA1ADORA2BADORA3 |
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-2588454-A1 | SUBSTITUTED DICYANOPYRIDINES AND USE THEREOF | Bayer Intellectual Property GmbH (DE) | 2013-05-08 | — | — | EP | disclosed |
| WO-2012000945-A1 | SUBSTITUTED DICYANOPYRIDINES AND USE THEREOF | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2012-01-05 | — | — | WO | disclosed |