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 SCHEMBL1109613 | 1.00 | CA2 (0.42) | — | |
| Iodide SCHEMBL1425585 | 1.00 | CA2 (0.42) | — | |
| Iodide SCHEMBL3851713 | 1.00 | — | — | |
| SCHEMBL88352 | 0.94 | — | — | |
| SCHEMBL634685 | 0.94 | CA2 (0.46) | — | |
| SCHEMBL2486859 | 0.94 | CA2 (0.46) | — | |
| SCHEMBL31402615 | 0.94 | CA2 (0.46) | — | |
| SCHEMBL8332638 | 0.89 | — | — | |
| Water SCHEMBL17318091 | 0.89 | — | — | |
| SCHEMBL7191422 | 0.89 | CA2 (0.42) | — |
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-108602923-B | Radiation curable compositions | 佩什托普公司 | 2021-10-26 | — | — | CN | disclosed |