Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 5/20 | 0.59 |
| ▸ | DRD4 | P21917 | 2/20 | 0.59 |
| ▸ | DRD3 | P35462 | 1/20 | 0.59 |
| ▸ | HTR1A | P08908 | 4/20 | 0.58 |
| ▸ | HTR7 | P34969 | 4/20 | 0.58 |
| ▸ | HTR2A | P28223 | 3/20 | 0.58 |
| ▸ | HTR6 | P50406 | 3/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL27351820 | 0.86 | DRD2 (0.58) | DRD2DRD4DRD3HTR1AHTR7 | |
| SCHEMBL9612238 | 0.85 | DRD2 (0.62) | DRD2DRD4DRD3HTR1AHTR7 | |
| SCHEMBL3210388 | 0.85 | DRD2 (0.59) | DRD2DRD4DRD3HTR1AHTR7 | |
| SCHEMBL3210395 | 0.85 | DRD2 (0.60) | DRD2DRD4DRD3HTR1AHTR7 | |
| SCHEMBL3482338 | 0.84 | SIGMAR1 (0.72) | DRD2DRD4DRD3HTR1AHTR7 | |
| SCHEMBL23536279 | 0.83 | HTR1A (0.58) | DRD2DRD4DRD3HTR1AHTR7 | |
| SCHEMBL9155290 | 0.83 | HTR1A (0.58) | DRD2DRD4DRD3HTR1AHTR7 | |
| SCHEMBL29932017 | 0.83 | HTR1A (0.58) | DRD2DRD4DRD3HTR1AHTR7 | |
| SCHEMBL18118448 | 0.82 | DRD2 (0.58) | DRD2DRD4DRD3HTR1AHTR7 | |
| Hydrochloric Acid SCHEMBL31232826 | 0.82 | HTR1A (0.57) | DRD2DRD4DRD3HTR1AHTR7 |
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 |
|---|---|---|---|---|---|---|---|
| US-5688795-A | URINARY TRACTS OBSTRUCTION | SYNTEX (U.S.A.) INC. (US) | 1997-11-18 | — | — | US | disclosed |
| CN-1136039-A | [3- (4-phenylpiperazin-1-yl) propylamino, thio and oxy ] -pyridine, pyrimidine and benzene derivatives | HOFFMANN LA ROCHE (CH) | 1996-11-20 | — | — | CN | disclosed |
| EP-0711757-A1 | 3-(4-phenylpiperazin-1-yl)propyl-amino, thio and oxy -pyridine, pyrimidine and benzene derivatives as alpha1-adrenoceptor antagonists | F. Hoffmann-La Roche AG (CH) | 1996-05-15 | — | — | EP | disclosed |