Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
The experimentally established mechanism targets of Bromide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A known ✓ | P08913 | 3/20 | 0.53 |
| ▸ | HTR1A known ✓ | P08908 | 1/20 | 0.53 |
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.53 |
| ▸ | ADRA1D known ✓ | P25100 | 1/20 | 0.53 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.53 |
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.53 |
| ▸ | ADRA1B known ✓ | P35368 | 1/20 | 0.53 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.53 |
| ▸ | DRD1 | P21728 | 12/20 | 0.70 |
| ▸ | DRD2 | P14416 | 8/20 | 0.70 |
| ▸ | DRD3 | P35462 | 2/20 | 0.70 |
| ▸ | DRD4 | P21917 | 1/20 | 0.70 |
| ▸ | DRD5 | P21918 | 1/20 | 0.70 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.60 |
| ▸ | MAPT | P10636 | 5/20 | 0.60 |
| ▸ | PMP22 | Q01453 | 5/20 | 0.60 |
| ▸ | BLM | P54132 | 3/20 | 0.60 |
| ▸ | PKM | P14618 | 2/20 | 0.60 |
| ▸ | LMNA | P02545 | 2/20 | 0.60 |
| ▸ | GMNN | O75496 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL11243724 | 0.99 | DRD1 (0.72) | DRD1DRD2DRD3DRD4DRD5 | |
| SCHEMBL11240206 | 0.92 | DRD2 (0.75) | DRD1DRD2DRD3DRD4DRD5 | |
| Bromide SCHEMBL11245427 | 0.84 | DRD2 (0.53) | DRD1DRD2DRD3DRD4DRD5 | |
| Bromide SCHEMBL11101325 | 0.84 | DRD2 (0.98) | DRD1DRD2DRD3DRD4DRD5 | |
| Bromide SCHEMBL11496865 | 0.83 | DRD1 (0.82) | DRD1DRD2DRD3DRD4DRD5 | |
| SCHEMBL11273914 | 0.83 | DRD2 (1.00) | DRD1DRD2DRD3DRD4DRD5 | |
| Bromide SCHEMBL11243599 | 0.82 | DRD2 (0.59) | DRD1DRD2DRD3DRD4DRD5 | |
| SCHEMBL11247867 | 0.82 | DRD2 (0.69) | DRD1DRD2DRD3DRD4DRD5 | |
| SCHEMBL11099766 | 0.82 | DRD1 (0.82) | DRD1DRD2DRD3DRD4DRD5 | |
| SCHEMBL15996611 | 0.79 | 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 | disclosed |
| EP-0044709-A1 | New dopaminergic benzazepines | SMITHKLINE BECKMAN CORPORATION (US) | 1982-01-27 | — | — | EP | disclosed |