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 | |
|---|---|---|---|---|
| SCHEMBL10654026 | 0.67 | — | — | |
| SCHEMBL10654009 | 0.64 | — | — | |
| SCHEMBL20159839 | 0.63 | — | — | |
| SCHEMBL10656774 | 0.63 | — | — | |
| SCHEMBL8424470 | 0.63 | — | — | |
| SCHEMBL3392640 | 0.63 | — | — | |
| SCHEMBL10654610 | 0.62 | — | — | |
| Thiosemicarbazide SCHEMBL18890136 | 0.61 | — | — | |
| SCHEMBL22420259 | 0.61 | — | — | |
| SCHEMBL8301128 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0176546-B1 | ISOTHIURONIUM SALTS | PEREMARTONI VEGYIPARI VALLALAT (HU) | 1988-03-02 | — | — | EP | disclosed |