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 | |
|---|---|---|---|---|
| SCHEMBL526055 | 0.97 | — | — | |
| SCHEMBL319656 | 0.95 | — | — | |
| Bromide SCHEMBL28615476 | 0.70 | TP53 (0.30) | — | |
| Bromide SCHEMBL31207605 | 0.69 | TP53 (0.31) | — | |
| SCHEMBL24419498 | 0.69 | OPRM1 (0.37) | — | |
| SCHEMBL5944642 | 0.68 | — | — | |
| SCHEMBL5289077 | 0.67 | — | — | |
| SCHEMBL3710858 | 0.67 | — | — | |
| SCHEMBL318638 | 0.65 | — | — | |
| SCHEMBL2012052 | 0.65 | LMNA (0.38) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20150158020-A1 | SYNTHESIS OF ZEOLITES USING AN ORGANOAMMONIUM COMPOUND | UOP LLC | 2015-06-11 | — | — | US | disclosed |
| US-8593714-B2 | Composite electrode and electrolytes comprising nanoparticles and resulting devices | AJJER, LLC (US) | 2013-11-26 | — | — | US | disclosed |
| US-20100039690-A1 | Composite electrode and electrolytes comprising nanoparticles and resulting devices | AJJER LLC (US) | 2010-02-18 | — | — | US | disclosed |