Known targets — ChEMBL curated mechanism
ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1
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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.41 |
| ▸ | CHKA known ✓ | P35790 | 1/20 | 0.36 |
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.34 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.57 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | MC4R | P32245 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL840566 | 0.98 | HIF1A (0.59) | HIF1ACHRNB4CHRNA3BCHEACHE | |
| Water SCHEMBL16037174 | 0.96 | HIF1A (0.57) | HIF1ACHRNB4CHRNA3BCHEACHE | |
| SCHEMBL13326546 | 0.82 | HIF1A (0.58) | HIF1ACHRNB4CHRNA3BCHEACHE | |
| SCHEMBL5272909 | 0.82 | HIF1A (0.44) | HIF1ACHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL14951080 | 0.81 | HIF1A (0.39) | HIF1ACHRNB4CHRNA3BCHEACHE | |
| Hydrochloric Acid SCHEMBL11729334 | 0.80 | HIF1A (0.56) | HIF1ACHRNB4CHRNA3BCHEACHE | |
| SCHEMBL12018095 | 0.80 | HIF1A (0.58) | HIF1ACHRNB4CHRNA3SIGMAR1CHRNB2 | |
| Bromide SCHEMBL3874382 | 0.78 | CA2 (0.44) | HIF1A | |
| SCHEMBL10257249 | 0.77 | HIF1A (0.53) | HIF1ACHRNB4CHRNA3BCHEACHE | |
| SCHEMBL5272906 | 0.76 | HIF1A (0.39) | HIF1ACHRNB4CHRNA3CHRNB2CHRNA4 |
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-4244202-A1 | METHOD OF SYNTHESIS | University of Durham (GB) | 2023-09-20 | — | — | EP | disclosed |
| WO-2022101627-A1 | METHOD OF SYNTHESIS | UNIVERSITY OF DURHAM (GB) | 2022-05-19 | — | — | WO | disclosed |