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 | |
|---|---|---|---|---|
| SCHEMBL7859046 | 0.95 | — | — | |
| SCHEMBL83837 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL28817781 | 0.90 | — | — | |
| SCHEMBL5523495 | 0.70 | — | — | |
| SCHEMBL1038317 | 0.70 | — | — | |
| SCHEMBL5532606 | 0.70 | — | — | |
| SCHEMBL10013263 | 0.70 | — | — | |
| SCHEMBL9576002 | 0.67 | — | — | |
| Ammonia Solution, Strong SCHEMBL9346362 | 0.67 | — | — | |
| SCHEMBL1265463 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105555911-B | Electrochromic list and two core viologens and the optical article containing it | 埃西勒国际通用光学公司 | 2018-02-27 | — | — | CN | disclosed |
| CN-105555911-A | Electrochromic single and two-core viologens and optical articles containing them | ESSILOR INT CIE GENERALE D'OPTIQUE | 2016-05-04 | — | — | CN | disclosed |