Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 11/20 | 0.72 |
| ▸ | DRD2 | P14416 | 8/20 | 0.72 |
| ▸ | DRD3 | P35462 | 2/20 | 0.72 |
| ▸ | DRD4 | P21917 | 1/20 | 0.72 |
| ▸ | DRD5 | P21918 | 1/20 | 0.72 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.60 |
| ▸ | THPO | P40225 | 4/20 | 0.60 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.60 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.60 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.60 |
| ▸ | MTOR | P42345 | 2/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.59 |
| ▸ | MAPT | P10636 | 4/20 | 0.59 |
| ▸ | PMP22 | Q01453 | 4/20 | 0.59 |
| ▸ | BLM | P54132 | 3/20 | 0.59 |
| ▸ | PKM | P14618 | 2/20 | 0.59 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL11243300 | 0.99 | DRD1 (0.70) | DRD1DRD2DRD3DRD4DRD5 | |
| SCHEMBL11240206 | 0.93 | DRD2 (0.75) | DRD1DRD2DRD3DRD4DRD5 | |
| SCHEMBL11273914 | 0.83 | DRD2 (1.00) | DRD1DRD2DRD3DRD4DRD5 | |
| Bromide SCHEMBL11101325 | 0.83 | DRD2 (0.98) | DRD1DRD2DRD3DRD4DRD5 | |
| Bromide SCHEMBL11245427 | 0.83 | DRD2 (0.53) | DRD1DRD2DRD3DRD4DRD5 | |
| SCHEMBL11247867 | 0.83 | DRD2 (0.69) | DRD1DRD2DRD3DRD4DRD5 | |
| SCHEMBL11099766 | 0.82 | DRD1 (0.82) | DRD1DRD2DRD3DRD4DRD5 | |
| Bromide SCHEMBL11496865 | 0.81 | DRD1 (0.82) | DRD1DRD2DRD3DRD4DRD5 | |
| Bromide SCHEMBL11243599 | 0.81 | DRD2 (0.59) | DRD1DRD2DRD3DRD4DRD5 | |
| SCHEMBL15996611 | 0.80 | DRD1 (0.66) | DRD1DRD2DRD3DRD4DRD5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4328153-A | HYPOTENSIVE AGENT | SMITH KLINE CORPORATION (US) | 1982-05-04 | — | — | US | claimed |
| EP-0044709-A1 | New dopaminergic benzazepines | SMITHKLINE BECKMAN CORPORATION (US) | 1982-01-27 | — | — | EP | claimed |