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 | |
|---|---|---|---|---|
| ▸ | 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 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.67 |
| ▸ | MAPT | P10636 | 4/20 | 0.67 |
| ▸ | BLM | P54132 | 4/20 | 0.67 |
| ▸ | PMP22 | Q01453 | 3/20 | 0.67 |
| ▸ | PKM | P14618 | 2/20 | 0.67 |
| ▸ | GMNN | O75496 | 2/20 | 0.67 |
| ▸ | LMNA | P02545 | 2/20 | 0.67 |
| ▸ | GAA | P10253 | 1/20 | 0.67 |
| ▸ | GFER | P55789 | 1/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.66 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.66 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.66 |
| ▸ | THPO | P40225 | 3/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL11088986 | 0.99 | DRD2 (0.80) | DRD2DRD1DRD4DRD5DRD3 | |
| SCHEMBL11097285 | 0.92 | DRD2 (0.82) | DRD2DRD1DRD4DRD5DRD3 | |
| Bromide SCHEMBL11101325 | 0.89 | DRD2 (0.98) | DRD2DRD1DRD4DRD5DRD3 | |
| SCHEMBL11273914 | 0.88 | DRD2 (1.00) | DRD2DRD1DRD4DRD5DRD3 | |
| Bromide SCHEMBL11094035 | 0.87 | DRD2 (0.78) | DRD2DRD1DRD4DRD5DRD3 | |
| Bromide SCHEMBL11093003 | 0.87 | DRD2 (0.62) | DRD2DRD1DRD4DRD5DRD3 | |
| SCHEMBL11096642 | 0.85 | DRD2 (0.64) | DRD2DRD1DRD4DRD5DRD3 | |
| Bromide SCHEMBL29634865 | 0.81 | DRD1 (1.00) | DRD2DRD1DRD4DRD5DRD3 | |
| Bromide SCHEMBL4081594 | 0.81 | DRD1 (1.00) | DRD2DRD1DRD4DRD5DRD3 | |
| Bromide SCHEMBL11496230 | 0.80 | DRD1 (0.98) | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4340601-A | VASODILATION | SMITHKLINE CORPORATION (US) | 1982-07-20 | — | — | US | claimed |
| EP-0043729-B1 | NEW DOPAMINERGIC ISOQUINOLINES | SMITHKLINE BECKMAN CORPORATION (US) | 1984-02-01 | — | — | EP | disclosed |
| US-4340601-A | VASODILATION | SMITHKLINE CORPORATION (US) | 1982-07-20 | — | — | US | disclosed |
| EP-0043729-A1 | New dopaminergic isoquinolines | SMITHKLINE BECKMAN CORPORATION (US) | 1982-01-13 | — | — | EP | disclosed |