Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | C5AR1 | P21730 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 6/20 | 0.35 |
| ▸ | DRD1 | P21728 | 5/20 | 0.35 |
| ▸ | HTR2C | P28335 | 5/20 | 0.35 |
| ▸ | DRD3 | P35462 | 5/20 | 0.35 |
| ▸ | DRD5 | P21918 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | PDE5A | O76074 | 2/20 | 0.34 |
| ▸ | PSEN1 | P49768 | 4/20 | 0.33 |
| ▸ | PSEN2 | P49810 | 4/20 | 0.33 |
| ▸ | APH1B | Q8WW43 | 4/20 | 0.33 |
| ▸ | NCSTN | Q92542 | 4/20 | 0.33 |
| ▸ | APH1A | Q96BI3 | 4/20 | 0.33 |
| ▸ | PSENEN | Q9NZ42 | 4/20 | 0.33 |
| ▸ | DRD2 | P14416 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL648140 | 0.93 | C5AR1 (0.44) | C5AR1DRD4DRD1HTR2CDRD3 | |
| SCHEMBL651135 | 0.92 | C5AR1 (0.41) | C5AR1DRD4DRD1HTR2CDRD3 | |
| SCHEMBL5135166 | 0.91 | C5AR1 (0.45) | C5AR1ALDH1A1HDAC1CRHR1KDM4E | |
| SCHEMBL5137096 | 0.91 | C5AR1 (0.42) | C5AR1DRD4DRD1HTR2CDRD3 | |
| SCHEMBL649094 | 0.89 | C5AR1 (0.43) | C5AR1ALDH1A1HDAC1CRHR1KDM4E | |
| SCHEMBL651431 | 0.89 | C5AR1 (0.43) | C5AR1PDE5AALDH1A1HDAC1CRHR1 | |
| SCHEMBL5136024 | 0.89 | C5AR1 (0.41) | C5AR1TP53GAASMN1; SMN2POLB | |
| SCHEMBL5136497 | 0.89 | C5AR1 (0.41) | C5AR1TP53ALDH1A1KDM4ECYP3A4 | |
| SCHEMBL651006 | 0.88 | C5AR1 (0.42) | C5AR1ALDH1A1HDAC1CRHR1KDM4E | |
| SCHEMBL649931 | 0.88 | C5AR1 (0.47) | C5AR1TP53GAASMN1; SMN2ALDH1A1 |
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 |