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 SCHEMBL471883 | 1.00 | — | — | |
| Iodide SCHEMBL28587425 | 0.82 | — | — | |
| Water SCHEMBL31430927 | 0.82 | — | — | |
| SCHEMBL28005566 | 0.71 | — | — | |
| SCHEMBL28227086 | 0.71 | — | — | |
| SCHEMBL29385040 | 0.71 | — | — | |
| Iodide SCHEMBL28916237 | 0.71 | CA4 (0.50) | — | |
| Hydrogen Sulfide SCHEMBL533430 | 0.71 | — | — | |
| Water SCHEMBL16776762 | 0.71 | — | — | |
| Iodide SCHEMBL284808 | 0.50 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7341002-B1 | Missile countermeasure device, and methods of using same | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2008-03-11 | — | — | US | disclosed |
| EP-1646354-A2 | SMALL SPHERICAL PARTICLES OF LOW MOLECULAR WEIGHT ORGANIC MOLECULES AND METHODS OF PREPARATION AND USE THEREOF | BAXTER INTERNATIONAL INC. (US) | 2006-04-19 | — | — | EP | disclosed |
| US-20050048127-A1 | Small spherical particles of low molecular weight organic molecules and methods of preparation and use thereof | BAXTER HEALTHCARE S.A. (CH) | 2005-03-03 | — | — | US | disclosed |
| WO-2005009375-A2 | SMALL SPHERICAL PARTICLES OF LOW MOLECULAR WEIGHT ORGANIC MOLECULES AND METHODS OF PREPARATION AND USE THEREOF | BAXTER INTERNATIONAL INC. (US) | 2005-02-03 | — | — | WO | disclosed |