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 | |
|---|---|---|---|---|
| SCHEMBL146744 | 0.87 | — | — | |
| SCHEMBL31612448 | 0.75 | — | — | |
| SCHEMBL1466488 | 0.75 | — | — | |
| Hydrogen Sulfide SCHEMBL28526709 | 0.75 | — | — | |
| SCHEMBL1325556 | 0.75 | — | — | |
| SCHEMBL31016474 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL3426323 | 0.75 | — | — | |
| SCHEMBL3308839 | 0.75 | — | — | |
| Fluoride SCHEMBL5442048 | 0.75 | — | — | |
| SCHEMBL29148027 | 0.75 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1663978-A | Process for preparing polycarbonate with optical activity | UNIV DALIAN TECH (CN) | 2005-09-07 | — | — | CN | claimed |
| US-20070231579-A1 | WELDABLE COATING COMPOSITIONS, SUBSTRATES AND RELATED METHODS | PPG INDUSTRIES OHIO, INC. (US) | 2007-10-04 | — | — | US | disclosed |
| CN-1663978-A | Process for preparing polycarbonate with optical activity | UNIV DALIAN TECH (CN) | 2005-09-07 | — | — | CN | disclosed |
| EP-0944564-A1 | HALOGEN EXCHANGE REACTIONS AND USES THEREOF | ALBEMARLE CORPORATION (US) | 1999-09-29 | — | — | EP | disclosed |
| WO-1998022413-A1 | HALOGEN EXCHANGE REACTIONS AND USES THEREOF | ALBEMARLE CORPORATION (US) | 1998-05-28 | — | — | WO | disclosed |