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 | |
|---|---|---|---|---|
| ▸ | HTR1A known ✓ | P08908 | 5/20 | 0.43 |
| ▸ | ADRA2A known ✓ | P08913 | 2/20 | 0.43 |
| ▸ | ADRA2C known ✓ | P18825 | 2/20 | 0.43 |
| ▸ | SLC6A2 known ✓ | P23975 | 2/20 | 0.43 |
| ▸ | ADRA1A known ✓ | P35348 | 2/20 | 0.43 |
| ▸ | SIGMAR1 known ✓ | Q99720 | 1/20 | 0.43 |
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.40 |
| ▸ | ADRA1D known ✓ | P25100 | 1/20 | 0.40 |
| ▸ | HTR1D known ✓ | P28221 | 1/20 | 0.40 |
| ▸ | HTR1B known ✓ | P28222 | 1/20 | 0.40 |
| ▸ | ADRA1B known ✓ | P35368 | 1/20 | 0.40 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 7/20 | 0.46 |
| ▸ | DRD3 | P35462 | 6/20 | 0.46 |
| ▸ | DRD4 | P21917 | 5/20 | 0.46 |
| ▸ | HTR7 | P34969 | 6/20 | 0.43 |
| ▸ | HRH1 | P35367 | 3/20 | 0.43 |
| ▸ | HTR2B | P41595 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 5/20 | 0.43 |
| ▸ | F2 | P00734 | 1/20 | 0.43 |
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 SCHEMBL7425687 | 1.00 | DRD2 (0.46) | DRD2DRD3DRD4HTR7HTR1A | |
| Bromide SCHEMBL7425690 | 1.00 | DRD2 (0.46) | DRD2DRD3DRD4HTR7HTR1A | |
| Bromide SCHEMBL7418493 | 1.00 | DRD2 (0.46) | DRD2DRD3DRD4HTR7HTR1A | |
| SCHEMBL7425451 | 0.99 | DRD2 (0.47) | DRD2DRD3DRD4HTR7HTR1A | |
| SCHEMBL7419443 | 0.93 | DRD2 (0.50) | DRD2DRD3DRD4HTR7HTR1A | |
| SCHEMBL7426173 | 0.86 | PRMT5 (0.44) | DRD2DRD3DRD4HTR7HTR1A | |
| Hydrochloric Acid SCHEMBL7422561 | 0.85 | NPC1 (0.52) | DRD2DRD3DRD4F2POLB | |
| Bromide SCHEMBL7365316 | 0.84 | F2 (0.52) | F2 | |
| Bromide SCHEMBL7365314 | 0.84 | F2 (0.52) | F2 | |
| SCHEMBL7426600 | 0.84 | DRD2 (0.46) | DRD2DRD3DRD4HTR7HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0815103-A1 | TRYPSIN AND THROMBIN INHIBITORS | Novartis AG (CH) | 1998-01-07 | — | — | EP | disclosed |
| WO-1996029327-A1 | TRYPSIN AND THROMBIN INHIBITORS | NOVARTIS AG (CH) | 1996-09-26 | — | — | WO | disclosed |