Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 6/20 | 0.39 |
| ▸ | DRD2 | P14416 | 5/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD5 | P21918 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | KDM2B | Q8NHM5 | 2/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | THPO | P40225 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GMNN | O75496 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11216105 | 0.85 | DRD1 (0.50) | DRD1DRD2DRD5MTORCYP1A2 | |
| SCHEMBL11283177 | 0.85 | DRD2 (0.56) | DRD1DRD2DRD4DRD5DRD3 | |
| SCHEMBL11309660 | 0.83 | HRH3 (0.37) | DRD1DRD2KDM2BMTORCYP1A2 | |
| Hydrochloric Acid SCHEMBL11253560 | 0.83 | KDM2B (0.38) | DRD2KDM2B | |
| Bromide SCHEMBL11242453 | 0.83 | KDM2B (0.37) | KDM2BCYP3A4CYP2D6 | |
| Bromide SCHEMBL11236726 | 0.79 | DRD2 (0.38) | DRD1DRD2DRD4DRD5DRD3 | |
| Hydrochloric Acid SCHEMBL11262602 | 0.78 | BCHE (0.50) | DRD1DRD2MTORCYP1A2CYP3A4 | |
| SCHEMBL13928827 | 0.77 | DRD1 (0.50) | DRD1DRD2DRD5MTORCYP1A2 | |
| SCHEMBL11529724 | 0.76 | DRD1 (0.46) | DRD1DRD2MTORCYP1A2CYP3A4 | |
| SCHEMBL7322313 | 0.76 | CYP2D6 (0.63) | DRD1DRD2DRD5MTORCYP1A2 |
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 | disclosed |
| EP-0044709-A1 | New dopaminergic benzazepines | SMITHKLINE BECKMAN CORPORATION (US) | 1982-01-27 | — | — | EP | disclosed |