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 | |
|---|---|---|---|---|
| SCHEMBL3035484 | 0.98 | — | — | |
| SCHEMBL3065194 | 0.79 | KDM4E (0.31) | — | |
| SCHEMBL28620678 | 0.70 | ALDH1A1 (0.33) | — | |
| SCHEMBL28530528 | 0.70 | CA1 (0.41) | — | |
| SCHEMBL28630000 | 0.68 | — | — | |
| Ammonia Solution, Strong SCHEMBL28621350 | 0.68 | ALDH1A1 (0.32) | — | |
| Lithium Ion SCHEMBL28625055 | 0.68 | — | — | |
| Potassium Ion SCHEMBL28633587 | 0.68 | — | — | |
| SCHEMBL6011944 | 0.68 | CA1 (0.35) | — | |
| SCHEMBL8726642 | 0.66 | CA1 (0.33) | — |
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-112654928-A | Positive photosensitive material | 默克专利股份有限公司 | 2021-04-13 | — | — | CN | disclosed |