Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 3/20 | 0.50 |
| ▸ | ATP4A | P20648 | 4/20 | 0.45 |
| ▸ | ATP4B | P51164 | 4/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 4/20 | 0.41 |
| ▸ | DRD3 | P35462 | 4/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5136614 | 0.97 | BCHE (0.49) | BCHEATP4AATP4BL3MBTL1C5AR1 | |
| SCHEMBL5135970 | 0.96 | BCHE (0.53) | BCHEATP4AATP4BL3MBTL1C5AR1 | |
| SCHEMBL5144498 | 0.95 | BCHE (0.46) | BCHEATP4AATP4BL3MBTL1C5AR1 | |
| SCHEMBL5070125 | 0.93 | L3MBTL1 (0.51) | BCHEATP4AATP4BL3MBTL1C5AR1 | |
| SCHEMBL5134960 | 0.93 | ATP4A (0.52) | ATP4AATP4BHRH3DRD2DRD3 | |
| SCHEMBL647665 | 0.92 | ATP4A (0.46) | ATP4AATP4BC5AR1HRH3DRD2 | |
| SCHEMBL5135786 | 0.92 | BCHE (0.44) | BCHEATP4AATP4BL3MBTL1C5AR1 | |
| SCHEMBL5137431 | 0.91 | ATP4A (0.50) | ATP4AATP4BHRH3DRD2DRD3 | |
| SCHEMBL5134735 | 0.90 | ATP4A (0.51) | ATP4AATP4BHRH3DRD2DRD3 | |
| SCHEMBL649161 | 0.90 | C5AR1 (0.47) | BCHEATP4AATP4BC5AR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1490044-A4 | COMBINATION THERAPY FOR THE TREATMENT OF CONDITIONS WITH PATHOGENIC INFLAMMATORY COMPONENTS | NEUROGEN CORP (US) | 2008-04-16 | — | — | EP | disclosed |
| EP-1490044-A1 | COMBINATION THERAPY FOR THE TREATMENT OF CONDITIONS WITH PATHOGENIC INFLAMMATORY COMPONENTS | NEUROGEN CORPORATION (US) | 2004-12-29 | — | — | EP | disclosed |
| WO-2003084524-A1 | COMBINATION THERAPY FOR THE TREATMENT OF CONDITIONS WITH PATHOGENIC INFLAMMATORY COMPONENTS | NEUROGEN CORPORATION (US) | 2003-10-16 | — | — | WO | disclosed |