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 SCHEMBL3209595 | 0.95 | NFKB1 (0.42) | — | |
| Bromide SCHEMBL759457 | 0.95 | — | — | |
| SCHEMBL27732900 | 0.95 | — | — | |
| Bromide SCHEMBL3209601 | 0.90 | — | — | |
| SCHEMBL232317 | 0.89 | — | — | |
| Fluoride Ion SCHEMBL1812697 | 0.84 | — | — | |
| Iodide SCHEMBL196407 | 0.84 | — | — | |
| SCHEMBL7553746 | 0.84 | — | — | |
| Water SCHEMBL28331162 | 0.84 | NFKB1 (0.42) | — | |
| Bromide SCHEMBL3209609 | 0.84 | — | — |
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-107699609-A | Gene tracer and the preparation method of false proof nano particle based on DNA and nano particle | 张毅 | 2018-02-16 | — | — | CN | disclosed |