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 | |
|---|---|---|---|---|
| SCHEMBL4227888 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL4228899 | 0.96 | — | — | |
| SCHEMBL4228218 | 0.86 | HRH3 (0.32) | — | |
| SCHEMBL4361607 | 0.86 | MEN1 (0.31) | — | |
| Iodide SCHEMBL17870265 | 0.86 | — | — | |
| Iodide SCHEMBL16164200 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL4370736 | 0.85 | KDM4E (0.30) | — | |
| Hydrochloric Acid SCHEMBL4232047 | 0.85 | HRH3 (0.32) | — | |
| SCHEMBL4360798 | 0.85 | KMT2A (0.37) | — | |
| SCHEMBL4233917 | 0.83 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006126861-A9 | SOLID-STATE ELECTROLYTE COMPOSITION CONTAINING LIQUID CRYSTAL MATERIALS AND DYE-SENSITIZED SOLAR CELLS USING THEREOF | BUSAN NAT UNIVERSITY INDUSTRY (KR) | 2007-03-15 | — | — | WO | disclosed |