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 | |
|---|---|---|---|---|
| SCHEMBL14208 | 0.97 | — | — | |
| Bromide SCHEMBL27763500 | 0.94 | LOXL2 (0.50) | — | |
| Bromide SCHEMBL9131563 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL3452396 | 0.94 | — | — | |
| SCHEMBL31540632 | 0.94 | — | — | |
| SCHEMBL27348535 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL11079689 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL11424635 | 0.94 | LOXL2 (0.50) | — | |
| Iodomethane SCHEMBL11482104 | 0.92 | RAB9A (0.48) | — | |
| Dimethylamine SCHEMBL6486963 | 0.89 | RAB9A (0.52) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009123675-A1 | IMPROVED CARBONYLATION PROCESS | EASTMAN CHEMICAL COMPANY (US) | 2009-10-08 | — | — | WO | disclosed |
| EP-0506240-B1 | Process for the recovery of acetic acid from compositions comprising acetic acid and water | BP CHEM INT LTD (GB) | 1996-02-07 | — | — | EP | disclosed |
| EP-0506240-A2 | Process for the recovery of acetic acid from compositions comprising acetic acid and water | BP Chemicals Limited (GB) | 1992-09-30 | — | — | EP | disclosed |