Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 6/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.45 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.39 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3328078 | 0.84 | MAPT (0.60) | ADORA2AADORA1MAPTNPSR1RXFP1 | |
| SCHEMBL3333404 | 0.66 | MAPT (0.81) | ADORA2AADORA1MAPTNPSR1RXFP1 | |
| SCHEMBL3339298 | 0.65 | KDM4E (0.51) | ADORA2AADORA1MAPTNPSR1RXFP1 | |
| SCHEMBL244863 | 0.64 | ADORA1 (0.61) | ADORA2AADORA1MAPTNPSR1RXFP1 | |
| SCHEMBL245478 | 0.64 | ADORA1 (0.65) | ADORA2AADORA1MAPTNPSR1RXFP1 | |
| SCHEMBL4031424 | 0.64 | ADORA1 (0.48) | ADORA2AADORA1MAPTNPSR1ALDH1A1 | |
| SCHEMBL6462984 | 0.63 | MAPT (0.59) | ADORA2AADORA1MAPTNPSR1RXFP1 | |
| SCHEMBL3548799 | 0.63 | KDM4E (0.49) | ADORA2AADORA1MAPTNPSR1RXFP1 | |
| SCHEMBL3605617 | 0.63 | PRF1 (0.44) | ADORA1MAPTNPSR1RXFP1ALDH1A1 | |
| SCHEMBL13879906 | 0.63 | ADORA1 (0.50) | ADORA2AADORA1MAPTNPSR1RXFP1 |
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 |