Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 4/20 | 0.56 |
| ▸ | DRD2 | P14416 | 3/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.55 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.47 |
| ▸ | DRD4 | P21917 | 2/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | PRCP | P42785 | 1/20 | 0.47 |
| ▸ | EBP | Q15125 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3037442 | 0.95 | DRD2 (0.62) | DRD3DRD2CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL566627 | 0.95 | DRD2 (0.62) | DRD3DRD2CYP2D6SLC6A2SLC6A4 | |
| Bromide SCHEMBL567330 | 0.93 | DRD2 (0.60) | DRD3DRD2CYP2D6SLC6A2SLC6A4 | |
| Bromide SCHEMBL3041691 | 0.93 | DRD2 (0.60) | DRD3DRD2CYP2D6SLC6A2SLC6A4 | |
| Hydrochloric Acid SCHEMBL3037511 | 0.93 | DRD2 (0.60) | DRD3DRD2CYP2D6SLC6A2SLC6A4 | |
| Hydrochloric Acid SCHEMBL3037509 | 0.93 | DRD2 (0.60) | DRD3DRD2CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL7405883 | 0.90 | DRD2 (0.55) | DRD3DRD2 | |
| SCHEMBL1661863 | 0.84 | HDAC4 (0.61) | DRD3DRD2SIGMAR1DRD4NFKB1 | |
| SCHEMBL11273445 | 0.82 | CYP2D6 (0.53) | DRD3DRD2CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL219530 | 0.82 | HDAC4 (0.59) | DRD3DRD2SIGMAR1DRD4NFKB1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4022764-A | 3-(Meta-oxyphenyl) hexahydroazepines | JOHN WYETH & BROTHER LIMITED (EN) | 1977-05-10 | — | — | US | disclosed |