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 | |
|---|---|---|---|---|
| SCHEMBL1432959 | 0.98 | — | — | |
| Bromide SCHEMBL28377855 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL8751189 | 0.95 | — | — | |
| Acetic Acid SCHEMBL10353287 | 0.88 | — | — | |
| SCHEMBL3311176 | 0.85 | — | — | |
| SCHEMBL14118630 | 0.83 | — | — | |
| SCHEMBL3304901 | 0.82 | — | — | |
| SCHEMBL3308240 | 0.82 | HSD17B10 (0.32) | — | |
| Sulfuric Acid SCHEMBL27444464 | 0.82 | — | — | |
| Sulfuric Acid SCHEMBL27444466 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5554446-A | Coated material, the preparation of use thereof | CIBA-GEIGY CORPORATION (US) | 1996-09-10 | — | — | US | disclosed |
| US-5413860-A | Coated material, the preparation and use thereof | CIBA-GEIGY CORPORATION (US) | 1995-05-09 | — | — | US | disclosed |