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 SCHEMBL8038404 | 0.87 | — | — | |
| Iodide SCHEMBL9443343 | 0.87 | — | — | |
| Iodide SCHEMBL9139223 | 0.87 | — | — | |
| Iodide SCHEMBL9481431 | 0.87 | — | — | |
| Iodide SCHEMBL176134 | 0.71 | — | — | |
| SCHEMBL762049 | 0.71 | — | — | |
| Iodide SCHEMBL532630 | 0.71 | — | — | |
| Iodide SCHEMBL11589059 | 0.71 | CA4 (0.50) | — | |
| Iodide SCHEMBL11319781 | 0.71 | — | — | |
| Iodide SCHEMBL9551827 | 0.71 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE35615-E | ION EXCHANGING | BP CHEMICALS LIMITED | 1997-09-23 | — | — | US | disclosed |
| US-5344976-A | Fluid flow through silver, mercury, palladium and/or rhodium-exchanged strong acid cation exchange resin | BP CHEMICALD LIMITED (GB) | 1994-09-06 | — | — | US | disclosed |