Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 12/20 | 0.76 |
| ▸ | DRD2 | P14416 | 7/20 | 0.76 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.76 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.76 |
| ▸ | THPO | P40225 | 5/20 | 0.76 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.76 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.76 |
| ▸ | MTOR | P42345 | 4/20 | 0.76 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.76 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.76 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.76 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.76 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.74 |
| ▸ | MAPT | P10636 | 5/20 | 0.74 |
| ▸ | PKM | P14618 | 3/20 | 0.74 |
| ▸ | PMP22 | Q01453 | 3/20 | 0.74 |
| ▸ | LMNA | P02545 | 2/20 | 0.74 |
| ▸ | GMNN | O75496 | 1/20 | 0.74 |
| ▸ | GAA | P10253 | 1/20 | 0.74 |
| ▸ | BLM | P54132 | 1/20 | 0.74 |
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 SCHEMBL11157745 | 0.99 | DRD1 (0.77) | DRD1DRD2HSD17B10CYP2D6THPO | |
| SCHEMBL7318885 | 0.89 | DRD1 (0.74) | DRD1DRD2HSD17B10CYP2D6THPO | |
| Hydrochloric Acid SCHEMBL11259919 | 0.89 | DRD1 (0.64) | DRD1DRD2HSD17B10CYP2D6THPO | |
| Bromide SCHEMBL7321599 | 0.88 | DRD1 (0.75) | DRD1DRD2HSD17B10CYP2D6THPO | |
| Hydrochloric Acid SCHEMBL11526383 | 0.87 | DRD1 (0.72) | DRD1DRD2HSD17B10CYP2D6THPO | |
| SCHEMBL4388800 | 0.86 | DRD1 (1.00) | DRD1DRD2HSD17B10CYP2D6THPO | |
| SCHEMBL29388918 | 0.86 | DRD1 (1.00) | DRD1DRD2HSD17B10CYP2D6THPO | |
| SCHEMBL29389918 | 0.86 | DRD1 (1.00) | DRD1DRD2HSD17B10CYP2D6THPO | |
| Hydrochloric Acid SCHEMBL11253440 | 0.86 | DRD1 (0.64) | DRD1DRD2HSD17B10CYP2D6THPO | |
| Hydrochloric Acid SCHEMBL11260714 | 0.86 | DRD1 (0.64) | DRD1DRD2HSD17B10CYP2D6THPO |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4359464-A | 3-Furylmethyl-6-halo-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepines and antihypertensive use thereof | SMITHKLINE BECKMAN CORPORATION (US) | 1982-11-16 | — | — | US | disclosed |
| US-4352754-A | HYPOTENSIVE, ANTI-PARKINSON | SMITHKLINE CORPORATION (US) | 1982-10-05 | — | — | US | disclosed |
| US-4255422-A | DIURETICS, TREATMENT OF CARDIOVASCULAR DISORDERS | SMITHKLINE CORPORATION (US) | 1981-03-10 | — | — | US | disclosed |
| US-4160765-A | Method for 6-bromination of 1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine compounds | SMITHKLINE CORPORATION (US) | 1979-07-10 | — | — | US | disclosed |