Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | C5AR1 | P21730 | 1/20 | 0.34 |
| ▸ | NR1D1 | P20393 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.30 |
| ▸ | BCHE | P06276 | 3/20 | 0.30 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5135032 | 0.91 | C5AR1 (0.39) | C5AR1HDAC1ALDH1A1HPGDTSHR | |
| SCHEMBL5135460 | 0.87 | C5AR1 (0.36) | C5AR1HDAC1ALDH1A1HPGDTSHR | |
| SCHEMBL5134976 | 0.87 | C5AR1 (0.37) | C5AR1HDAC1ALDH1A1HPGDTSHR | |
| SCHEMBL5135007 | 0.84 | ALDH1A1 (0.35) | C5AR1ALDH1A1HPGDKDM4E | |
| SCHEMBL5135152 | 0.84 | C5AR1 (0.41) | C5AR1HDAC1ALDH1A1HPGDTSHR | |
| SCHEMBL5135866 | 0.83 | C5AR1 (0.39) | C5AR1HDAC1ALDH1A1HPGDTSHR | |
| SCHEMBL5072326 | 0.83 | C5AR1 (0.41) | C5AR1NR1D1HDAC1ALDH1A1HPGD | |
| SCHEMBL5138010 | 0.83 | C5AR1 (0.41) | C5AR1NR1D1HDAC1ALDH1A1KDM4E | |
| SCHEMBL651501 | 0.83 | C5AR1 (0.44) | C5AR1HDAC1ALDH1A1HPGDTSHR | |
| SCHEMBL5135466 | 0.82 | C5AR1 (0.39) | C5AR1HDAC1ALDH1A1HPGDTSHR |
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 |