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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 SCHEMBL3474229 | 0.82 | — | — | |
| Bromide SCHEMBL18485 | 0.82 | — | — | |
| Bromide SCHEMBL19000 | 0.82 | — | — | |
| Water SCHEMBL840153 | 0.67 | — | — | |
| Bromide SCHEMBL16290293 | 0.67 | — | — | |
| Water SCHEMBL11239599 | 0.67 | — | — | |
| Bromide SCHEMBL6262403 | 0.67 | — | — | |
| Bromide SCHEMBL812148 | 0.67 | — | — | |
| Bromide SCHEMBL11659262 | 0.67 | — | — | |
| Bromide SCHEMBL21063374 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109821533-B | Transition metal boride catalyst, preparation method and application thereof | 吉林大学 | 2021-09-21 | — | — | CN | disclosed |