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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 known ✓ | Q99720 | 8/20 | 0.45 |
| ▸ | SLC6A2 known ✓ | P23975 | 3/20 | 0.45 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.45 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5087727 | 0.96 | SIGMAR1 (0.45) | SIGMAR1TAAR1SLC6A2MAOASLC6A4 | |
| Iodide SCHEMBL5091767 | 0.96 | SIGMAR1 (0.45) | SIGMAR1TAAR1SLC6A2MAOASLC6A4 | |
| Bromide SCHEMBL5087866 | 0.78 | TRPA1 (0.44) | SIGMAR1TAAR1SLC6A2MAOASLC6A4 | |
| Bromide SCHEMBL5091831 | 0.77 | TAAR1 (0.50) | SIGMAR1TAAR1SLC6A2MAOASLC6A4 | |
| Bromide SCHEMBL5092930 | 0.75 | SIGMAR1 (0.41) | SIGMAR1TAAR1SLC6A2MAOASLC6A4 | |
| SCHEMBL8915534 | 0.74 | TAAR1 (0.52) | SIGMAR1TAAR1SLC6A2MAOASLC6A4 | |
| Iodide SCHEMBL5086720 | 0.74 | TRPA1 (0.44) | SIGMAR1TAAR1SLC6A2MAOASLC6A4 | |
| Hydrochloric Acid SCHEMBL5091634 | 0.74 | TRPA1 (0.44) | SIGMAR1TAAR1SLC6A2MAOASLC6A4 | |
| Hydrochloric Acid SCHEMBL5085050 | 0.73 | TAAR1 (0.50) | SIGMAR1TAAR1SLC6A2MAOASLC6A4 | |
| Iodide SCHEMBL5092961 | 0.73 | TAAR1 (0.50) | SIGMAR1TAAR1SLC6A2MAOASLC6A4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080214386-A1 | Stability; easily separated from solution; surface treatment of catalyst with Group seven compound; reacting epoxide with carbon dioxide | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2008-09-04 | — | — | US | disclosed |