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 2)
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 SCHEMBL11598209 | 0.97 | CYP2C19 (0.41) | CYP2C19HIF1A | |
| Hydrochloric Acid SCHEMBL11597876 | 0.81 | CYP2C19 (0.43) | CYP2C19 | |
| Hydrochloric Acid SCHEMBL11598099 | 0.81 | HIF1A (0.41) | CYP2C19HIF1A | |
| Bromide SCHEMBL4637900 | 0.73 | HIF1A (0.40) | CYP2C19HIF1A | |
| Bromide SCHEMBL510812 | 0.72 | HIF1A (0.43) | CYP2C19HIF1A | |
| SCHEMBL8548093 | 0.69 | TDP1 (0.51) | CYP2C19HIF1A | |
| Iodide SCHEMBL5158487 | 0.68 | HIF1A (0.43) | CYP2C19HIF1A | |
| Hydrochloric Acid SCHEMBL28584063 | 0.66 | HIF1A (0.44) | CYP2C19HIF1A | |
| Bromide SCHEMBL9822359 | 0.66 | ALDH1A1 (0.39) | HIF1A | |
| Bromide SCHEMBL129506 | 0.65 | HIF1A (0.48) | CYP2C19HIF1A |
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-4075407-A | HETEROCYCLIC PHOSPHONIUM SALTS | G. D. SEARLE & CO. (US) | 1978-02-21 | — | — | US | disclosed |