Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 4/20 | 0.62 |
| ▸ | DRD2 | P14416 | 4/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | DRD4 | P21917 | 3/20 | 0.49 |
| ▸ | DRD3 | P35462 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7814671 | 0.86 | DRD2 (0.61) | HTR1ADRD2CYP2D6DRD4DRD3 | |
| SCHEMBL7815137 | 0.86 | HTR1A (0.61) | HTR1ADRD2CYP2D6DRD4DRD3 | |
| SCHEMBL16702063 | 0.86 | DRD2 (0.61) | HTR1ADRD2CYP2D6DRD4DRD3 | |
| SCHEMBL13533015 | 0.83 | HTR1A (0.81) | HTR1ADRD2 | |
| SCHEMBL7821674 | 0.80 | HTR1A (0.42) | HTR1ADRD2 | |
| SCHEMBL7821489 | 0.80 | HTR1A (0.46) | HTR1ADRD2 | |
| SCHEMBL7807446 | 0.79 | DRD2 (0.52) | HTR1ADRD2CYP2D6DRD4DRD3 | |
| SCHEMBL7826279 | 0.78 | HTR1A (0.42) | HTR1ADRD2 | |
| SCHEMBL16703679 | 0.78 | HRH3 (0.57) | DRD2SIGMAR1 | |
| SCHEMBL31051992 | 0.78 | HTR1A (0.50) | HTR1ADRD2 |
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-0633260-B1 | 2,3-Dihydro-1,4-benzodioxan-5-yl-piperazine derivatives having 5-HT1A-antagonistic activity | DUPHAR INT RES (NL) | 2001-11-07 | — | — | EP | disclosed |
| US-5462942-A | 2,3-dihydro-1,4-benzodioxin-5-yl-piperazine derivatives having 5-HT 1A-antagonistic activity | DUPHAR INTERNATIONAL RESEARCH B.V. (NL) | 1995-10-31 | — | — | US | disclosed |
| EP-0633260-A1 | 2,3-Dihydro-1,4-benzodioxin-5-yl-piperazine derivatives having 5-HT1A-antagonistic activity | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1995-01-11 | — | — | EP | disclosed |