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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL20440999 | 0.72 | — | — | |
| Bromide SCHEMBL9078997 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL19581452 | 0.67 | — | — | |
| SCHEMBL9061873 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL7638134 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL615511 | 0.67 | — | — | |
| SCHEMBL819940 | 0.67 | — | — | |
| SCHEMBL8770704 | 0.64 | — | — | |
| SCHEMBL8368498 | 0.64 | — | — | |
| Bromide SCHEMBL8649921 | 0.64 | — | — |
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-5556821-A | Catalyst component for the polymerization of olefins | NIPPON OIL COMPANY, LIMITED (JP) | 1996-09-17 | — | — | US | disclosed |