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 SCHEMBL7942535 | 1.00 | — | — | |
| Iodide SCHEMBL176899 | 1.00 | — | — | |
| Iodide SCHEMBL3382952 | 1.00 | — | — | |
| Iodide SCHEMBL3374494 | 1.00 | CA4 (0.50) | — | |
| Iodide SCHEMBL31472568 | 1.00 | — | — | |
| Iodide SCHEMBL27902781 | 1.00 | — | — | |
| Iodide SCHEMBL28105529 | 1.00 | — | — | |
| Iodide SCHEMBL27569 | 1.00 | — | — | |
| Iodide SCHEMBL69895 | 1.00 | — | — | |
| Iodide SCHEMBL9278729 | 0.82 | — | — |
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-109985667-A | The device and method for preparing organophosphine ligand catalyst online | 内蒙古伊泰煤基新材料研究院有限公司 | 2019-07-09 | — | — | CN | disclosed |