Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | C5AR1 | P21730 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | CNR2 | P34972 | 2/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL5136637 | 0.93 | C5AR1 (0.45) | C5AR1TSHRPIN1NPC1SMN1; SMN2 | |
| SCHEMBL5137880 | 0.92 | C5AR1 (0.45) | C5AR1TSHRPIN1AGTR1KDM4E | |
| SCHEMBL651094 | 0.89 | TSHR (0.50) | C5AR1TSHRSMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL649496 | 0.87 | C5AR1 (0.44) | C5AR1TSHRPIN1KDM4EALDH1A1 | |
| SCHEMBL4766671 | 0.86 | C5AR1 (0.44) | C5AR1TSHRNPC1KDM4EALDH1A1 | |
| SCHEMBL5074064 | 0.86 | LTA4H (0.45) | C5AR1TSHRPIN1AGTR1HDAC1 | |
| SCHEMBL5137576 | 0.86 | TLR7 (0.47) | C5AR1 | |
| SCHEMBL4766543 | 0.86 | C5AR1 (0.45) | C5AR1TSHRKDM4EALDH1A1HPGD | |
| SCHEMBL4770661 | 0.86 | C5AR1 (0.42) | C5AR1TSHRPIN1AGTR1ALDH1A1 | |
| SCHEMBL5135922 | 0.85 | C5AR1 (0.49) | C5AR1TSHRSMN1; SMN2KDM4EALDH1A1 |
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 |