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 | |
|---|---|---|---|---|
| SCHEMBL197537 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL5087337 | 0.95 | — | — | |
| Bromide SCHEMBL197840 | 0.95 | — | — | |
| Iodide SCHEMBL5088345 | 0.86 | FDPS (0.34) | — | |
| Iodide SCHEMBL5087523 | 0.84 | FDPS (0.37) | — | |
| Iodide SCHEMBL5091416 | 0.84 | — | — | |
| Iodide SCHEMBL11521073 | 0.83 | — | — | |
| SCHEMBL3299961 | 0.83 | FDPS (0.35) | — | |
| Iodide SCHEMBL5085172 | 0.82 | FDPS (0.40) | — | |
| Iodide SCHEMBL5091380 | 0.82 | FDPS (0.40) | — |
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-20080214386-A1 | Stability; easily separated from solution; surface treatment of catalyst with Group seven compound; reacting epoxide with carbon dioxide | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2008-09-04 | — | — | US | disclosed |