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 | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 3/20 | 0.70 |
| ▸ | SLC6A3 known ✓ | Q01959 | 3/20 | 0.70 |
| ▸ | ADRB2 known ✓ | P07550 | 3/20 | 0.70 |
| ▸ | ADRA1A known ✓ | P35348 | 2/20 | 0.70 |
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.70 |
| ▸ | ADRA2C known ✓ | P18825 | 1/20 | 0.70 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.70 |
| ▸ | ADRA2A known ✓ | P08913 | 2/20 | 0.56 |
| ▸ | HTR1A known ✓ | P08908 | 1/20 | 0.56 |
| ▸ | ADRA1D known ✓ | P25100 | 1/20 | 0.56 |
| ▸ | ADRA1B known ✓ | P35368 | 1/20 | 0.56 |
| ▸ | SIGMAR1 known ✓ | Q99720 | 2/20 | 0.47 |
| ▸ | DRD1 | P21728 | 4/20 | 0.70 |
| ▸ | DRD3 | P35462 | 4/20 | 0.70 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.70 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.70 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.70 |
| ▸ | HRH1 | P35367 | 1/20 | 0.70 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.70 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.70 |
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 | |
|---|---|---|---|---|
| SCHEMBL7272756 | 0.98 | DRD1 (0.72) | DRD1DRD3SLC6A2SLC6A3ADRB2 | |
| SCHEMBL28615035 | 0.98 | DRD1 (0.72) | DRD1DRD3SLC6A2SLC6A3ADRB2 | |
| SCHEMBL30350890 | 0.98 | DRD1 (0.72) | DRD1DRD3SLC6A2SLC6A3ADRB2 | |
| SCHEMBL38652366 | 0.97 | DRD1 (0.69) | DRD1DRD3SLC6A2SLC6A3ADRB2 | |
| Hydrochloric Acid SCHEMBL28524068 | 0.95 | DRD1 (0.68) | DRD1DRD3SLC6A2SLC6A3ADRB2 | |
| SCHEMBL17055963 | 0.92 | DRD1 (0.67) | DRD1DRD3SLC6A2SLC6A3ADRB2 | |
| SCHEMBL13068844 | 0.89 | DRD1 (0.66) | DRD1DRD3SLC6A2SLC6A3ADRB2 | |
| Bromide SCHEMBL7281386 | 0.86 | ADRB2 (0.77) | DRD1DRD3SLC6A2SLC6A3ADRB2 | |
| Dopexamine SCHEMBL5886070 | 0.85 | DRD1 (0.86) | DRD1DRD3SLC6A2SLC6A3ADRB2 | |
| Bromide SCHEMBL11808599 | 0.85 | ADRB2 (0.71) | DRD1DRD3SLC6A2SLC6A3ADRB2 |
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-5013760-A | Phenylethylamine derivatives and pharmaceutical use | FISONS PLC (GB) | 1991-05-07 | — | — | US | disclosed |
| EP-0072061-A1 | Amine derivatives, processes for their production and pharmaceutical compositions containing them | FISONS plc (GB) | 1983-02-16 | — | — | EP | disclosed |