Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | C5AR1 | P21730 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.38 |
| ▸ | NCOR2 | Q9Y618 | 4/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | PRCP | P42785 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 3/20 | 0.35 |
| ▸ | HTR2C | P28335 | 3/20 | 0.35 |
| ▸ | HTR2B | P41595 | 3/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL5136532 | 0.91 | C5AR1 (0.52) | C5AR1HDAC8HDAC1HDAC3NCOR2 | |
| SCHEMBL5136309 | 0.90 | C5AR1 (0.55) | C5AR1HDAC8HDAC1HDAC3NCOR2 | |
| SCHEMBL5136248 | 0.90 | C5AR1 (0.54) | C5AR1HDAC8HDAC1HDAC3NCOR2 | |
| SCHEMBL5135530 | 0.89 | HDAC8 (0.55) | C5AR1HDAC8HDAC1HDAC3NCOR2 | |
| SCHEMBL5135133 | 0.87 | C5AR1 (0.54) | C5AR1HDAC8HDAC1HDAC3NCOR2 | |
| SCHEMBL5135156 | 0.87 | C5AR1 (0.53) | C5AR1HDAC8HDAC1HDAC3NCOR2 | |
| SCHEMBL5134974 | 0.87 | C5AR1 (0.53) | C5AR1HDAC8HDAC1HDAC3NCOR2 | |
| SCHEMBL5136178 | 0.87 | C5AR1 (0.51) | C5AR1HDAC8ALDH1A1MEN1KMT2A | |
| SCHEMBL5134730 | 0.87 | C5AR1 (0.57) | C5AR1HDAC8HDAC1HDAC3NCOR2 | |
| SCHEMBL5134943 | 0.87 | C5AR1 (0.57) | C5AR1HDAC8HDAC1HDAC3NCOR2 |
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 |