Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.59 |
| ▸ | DRD2 | P14416 | 3/20 | 0.55 |
| ▸ | DRD3 | P35462 | 3/20 | 0.55 |
| ▸ | DRD1 | P21728 | 1/20 | 0.55 |
| ▸ | HTR2A | P28223 | 1/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.55 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | HTR5A | P47898 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 9/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31051835 | 1.00 | ADRB1 (0.59) | ADRB1DRD2DRD3DRD1HTR2A | |
| SCHEMBL31051815 | 0.83 | DRD2 (0.39) | ADRB1DRD2DRD3DRD1HTR2A | |
| SCHEMBL31052109 | 0.81 | ADRB1 (0.40) | ADRB1DRD2DRD3DRD1HTR2A | |
| SCHEMBL31052147 | 0.81 | HTR1A (0.39) | ADRB1DRD2DRD3DRD1HTR2A | |
| SCHEMBL31051833 | 0.81 | DRD2 (0.38) | ADRB1DRD2DRD3DRD1HTR2A | |
| SCHEMBL31052184 | 0.81 | DRD2 (0.55) | ADRB1DRD2DRD3DRD1HTR2A | |
| SCHEMBL7808439 | 0.81 | ADRB1 (0.59) | ADRB1DRD2DRD3DRD1HTR2A | |
| SCHEMBL16703491 | 0.81 | ADRB1 (0.59) | ADRB1DRD2DRD3DRD1HTR2A | |
| SCHEMBL1455855 | 0.81 | ADRB1 (0.59) | ADRB1DRD2DRD3DRD1HTR2A | |
| SCHEMBL31051842 | 0.81 | ADRB1 (0.59) | ADRB1DRD2DRD3DRD1HTR2A |
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 |