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 | |
|---|---|---|---|---|
| SCHEMBL607359 | 0.94 | — | — | |
| SCHEMBL52259 | 0.71 | — | — | |
| SCHEMBL22141681 | 0.71 | — | — | |
| SCHEMBL11664714 | 0.70 | LMNA (0.33) | — | |
| SCHEMBL324469 | 0.68 | — | — | |
| SCHEMBL1317224 | 0.68 | — | — | |
| Iodide SCHEMBL1728387 | 0.68 | — | — | |
| SCHEMBL162811 | 0.68 | — | — | |
| SCHEMBL2850706 | 0.67 | LMNA (0.39) | — | |
| SCHEMBL699189 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4118290-A | Process for the preparation of perfluoroethyl iodide | HOECHST AKTIENGESELLSCHAFT (DE) | 1978-10-03 | — | — | US | disclosed |