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 | |
|---|---|---|---|---|
| SCHEMBL277576 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL9876855 | 0.86 | — | — | |
| Bromide SCHEMBL22326332 | 0.86 | — | — | |
| Water SCHEMBL3824345 | 0.86 | — | — | |
| SCHEMBL29412471 | 0.77 | — | — | |
| SCHEMBL11440306 | 0.77 | — | — | |
| Methyl Alcohol SCHEMBL4903598 | 0.72 | — | — | |
| SCHEMBL10398435 | 0.71 | — | — | |
| SCHEMBL294441 | 0.67 | — | — | |
| SCHEMBL14047913 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-115161012-B | Perovskite material, thin film and solar cell device and preparation method thereof | 上海科技大学 | 2024-06-04 | — | — | CN | disclosed |
| CN-115161012-A | Perovskite material, thin film, solar cell device and preparation method thereof | 上海科技大学 | 2022-10-11 | — | — | CN | disclosed |