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 SCHEMBL9065611 | 0.87 | — | — | |
| SCHEMBL6992465 | 0.71 | — | — | |
| SCHEMBL10708430 | 0.71 | — | — | |
| Iodide SCHEMBL18707 | 0.71 | — | — | |
| Iodide SCHEMBL7209603 | 0.71 | — | — | |
| Iodide SCHEMBL16049528 | 0.71 | — | — | |
| SCHEMBL11047591 | 0.71 | — | — | |
| Iodide SCHEMBL4387250 | 0.71 | — | — | |
| Iodide SCHEMBL29157 | 0.71 | — | — | |
| SCHEMBL27557 | 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-5258549-A | Carbonylation of alcohols using a catalyst comprising rhodium and nickel supported on carbon | BP CHEMICALS LIMITED (GB) | 1993-11-02 | — | — | US | disclosed |
| EP-0335625-B1 | PROCESS FOR PREPARING CARBOXYLIC ACIDS | BP Chemicals Limited (GB) | 1993-06-23 | — | — | EP | disclosed |