Known targets — ChEMBL curated mechanism
ACHECHRM1CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNG
The experimentally established mechanism targets of Iodide. 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL6554 | 1.00 | — | — | |
| Iodide SCHEMBL20580954 | 1.00 | — | — | |
| Iodide SCHEMBL28508874 | 1.00 | — | — | |
| Iodide SCHEMBL4074560 | 1.00 | — | — | |
| Iodide SCHEMBL4600394 | 1.00 | — | — | |
| Iodide SCHEMBL5724504 | 0.82 | — | — | |
| Iodide SCHEMBL22616411 | 0.82 | — | — | |
| Iodide SCHEMBL8469346 | 0.82 | — | — | |
| Iodide SCHEMBL22462420 | 0.82 | — | — | |
| Bromide SCHEMBL14958466 | 0.82 | — | — |
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-113725414-A | Cathode material of aqueous zinc-iodine secondary battery, cathode of aqueous zinc-iodine secondary battery and aqueous zinc-iodine secondary battery | 郑州大学 | 2021-11-30 | — | — | CN | disclosed |