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 | |
|---|---|---|---|---|
| SCHEMBL311602 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL29426653 | 0.95 | — | — | |
| SCHEMBL152414 | 0.78 | — | — | |
| SCHEMBL523008 | 0.74 | — | — | |
| SCHEMBL13900819 | 0.72 | — | — | |
| SCHEMBL29030366 | 0.71 | — | — | |
| SCHEMBL3624729 | 0.69 | — | — | |
| SCHEMBL2514270 | 0.69 | — | — | |
| SCHEMBL4796797 | 0.68 | — | — | |
| SCHEMBL7220244 | 0.68 | — | — |
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-111683897-A | Digital nucleic acid amplification using encoded particles | 华盛顿大学 | 2020-09-18 | — | — | CN | disclosed |