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 | |
|---|---|---|---|---|
| SCHEMBL669936 | 0.96 | — | — | |
| SCHEMBL5982346 | 0.92 | TSHR (0.61) | — | |
| SCHEMBL29194421 | 0.92 | TSHR (0.61) | — | |
| Fluoride SCHEMBL2141888 | 0.92 | — | — | |
| Bromide SCHEMBL18229950 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL10556579 | 0.92 | — | — | |
| SCHEMBL5346871 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL28012646 | 0.80 | — | — | |
| Phosphine SCHEMBL559532 | 0.80 | — | — | |
| Hexane SCHEMBL9775403 | 0.78 | TSHR (0.78) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0522469-A2 | Preparation of poly(benz(ox, imid, thi)azole) polymers | EASTMAN KODAK COMPANY (US) | 1993-01-13 | — | — | EP | disclosed |
| US-5149755-A | Aroatmic amine and halide reactants | EASTMAN KODAK COMPANY (US) | 1992-09-22 | — | — | US | disclosed |