Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 10/20 | 0.78 |
| ▸ | DRD1 | P21728 | 8/20 | 0.78 |
| ▸ | DRD4 | P21917 | 1/20 | 0.78 |
| ▸ | DRD5 | P21918 | 1/20 | 0.78 |
| ▸ | DRD3 | P35462 | 1/20 | 0.78 |
| ▸ | MAPT | P10636 | 3/20 | 0.66 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.66 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.66 |
| ▸ | MTOR | P42345 | 3/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.66 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.66 |
| ▸ | THPO | P40225 | 2/20 | 0.66 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.66 |
| ▸ | TSHR | P16473 | 2/20 | 0.66 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.64 |
| ▸ | GMNN | O75496 | 2/20 | 0.64 |
| ▸ | LMNA | P02545 | 2/20 | 0.64 |
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 SCHEMBL11266639 | 0.99 | DRD2 (0.77) | DRD2DRD1DRD4DRD5DRD3 | |
| SCHEMBL11096642 | 0.90 | DRD2 (0.64) | DRD2DRD1DRD4DRD5DRD3 | |
| Bromide SCHEMBL11093003 | 0.89 | DRD2 (0.62) | DRD2DRD1DRD4DRD5DRD3 | |
| SCHEMBL11273914 | 0.88 | DRD2 (1.00) | DRD2DRD1DRD4DRD5DRD3 | |
| Bromide SCHEMBL11284237 | 0.87 | DRD2 (0.85) | DRD2DRD1DRD4DRD5DRD3 | |
| Bromide SCHEMBL11101325 | 0.87 | DRD2 (0.98) | DRD2DRD1DRD4DRD5DRD3 | |
| Bromide SCHEMBL11269618 | 0.87 | DRD2 (0.98) | DRD2DRD1DRD4DRD5DRD3 | |
| SCHEMBL14510732 | 0.82 | DRD1 (0.82) | DRD2DRD1DRD4DRD5DRD3 | |
| SCHEMBL11154726 | 0.82 | DRD2 (0.81) | DRD2DRD1DRD4DRD5DRD3 | |
| Bromide SCHEMBL11245427 | 0.81 | DRD2 (0.53) | DRD2DRD1DRD4DRD5DRD3 |
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-0020107-B1 | 3-ALLYL-7,8-DIHYDROXY-6-HALO-1-(4-HYDROXYPHENYL)-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE DERIVATIVES, PROCESS FOR PREPARING THEM AND COMPOSITIONS CONTAINING THEM | SMITHKLINE BECKMAN CORPORATION (US) | 1982-08-11 | — | — | EP | claimed |
| US-4251525-A | FOR TREATING ANGINA PECTORIS | SMITHKLINE CORPORATION (US) | 1981-02-17 | — | — | US | claimed |
| EP-0020107-A1 | 3-Allyl-7,8-dihydroxy-6-halo-1-(4-hydroxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine derivatives, process for preparing them and compositions containing them | SMITHKLINE BECKMAN CORPORATION (US) | 1980-12-10 | — | — | EP | claimed |