Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 15/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | RET | P07949 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12410900 | 0.92 | ADORA1 (0.43) | ADORA1SLC6A3RET | |
| SCHEMBL8002243 | 0.88 | ADORA1 (0.55) | ADORA1SLC6A3 | |
| SCHEMBL2281823 | 0.85 | MAPT (0.43) | ADORA1MAPTNPSR1NPC1LMNA | |
| SCHEMBL12376554 | 0.85 | ADORA1 (0.38) | ADORA1SLC6A3RET | |
| SCHEMBL7998326 | 0.85 | NPC1 (0.46) | ADORA1MAPTNPSR1NPC1LMNA | |
| SCHEMBL7999522 | 0.84 | ADORA1 (0.53) | ADORA1MAPTNPSR1NPC1LMNA | |
| SCHEMBL12553141 | 0.83 | ADORA1 (0.54) | ADORA1MAPTNPSR1NPC1LMNA | |
| SCHEMBL12164106 | 0.82 | ADORA1 (0.43) | ADORA1MAPTNPSR1NPC1LMNA | |
| SCHEMBL8003034 | 0.81 | ADORA1 (0.42) | ADORA1MAPTNPSR1NPC1LMNA | |
| SCHEMBL2284817 | 0.80 | ADORA1 (0.42) | ADORA1MAPTNPSR1NPC1LMNA |
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-2274299-B1 | HETEROARYL-SUBSTITUTED DICYANOPYRIDINES AND USE THEREOF FOR TREATMENT OF CARDIOVASCULAR DISEASES | BAYER IP GMBH (DE) | 2016-06-15 | — | — | EP | disclosed |
| WO-2009112155-A1 | HETEROARYL-SUBSTITUTED DICYANOPYRIDINES AND USE THEREOF FOR TREATMENT OF CARDIOVASCULAR DISEASES | BAYER SCHERING PHARMA AG (DE) | 2009-09-17 | — | — | WO | disclosed |