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 | |
|---|---|---|---|---|
| Bromide SCHEMBL22750622 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL25425320 | 0.90 | — | — | |
| Iodide SCHEMBL2080763 | 0.70 | — | — | |
| Ether SCHEMBL21295590 | 0.69 | TSHR (0.32) | — | |
| Iodide SCHEMBL9450704 | 0.60 | — | — | |
| Hydrochloric Acid SCHEMBL3189733 | 0.60 | — | — | |
| Iodide SCHEMBL2359394 | 0.60 | — | — | |
| SCHEMBL3806571 | 0.60 | — | — | |
| Iodide SCHEMBL1436846 | 0.60 | — | — | |
| SCHEMBL17836033 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20210206727-A1 | DETERRENTS FOR ARTHROPODS AND MARINE ORGANISMS | UNIV OF NORTH TEXAS HEALTH SCIENCE CENTER AT FORT WORTH (US) | 2021-07-08 | — | — | US | disclosed |
| US-10766866-B2 | Deterrents for arthropods and marine organisms | UNIVERSITY OF NORTH TEXAS HEALTH SCIENCE CENTER AT FORT WORTH (US) | 2020-09-08 | — | — | US | disclosed |
| US-20190292156-A1 | DETERRENTS FOR ARTHROPODS AND MARINE ORGANISMS | UNIVERSITY OF NORTH TEXAS HEALTH SCIENCE CENTER AT FORT WORTH | 2019-09-26 | — | — | US | disclosed |