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 SCHEMBL28549939 | 0.91 | — | — | |
| SCHEMBL1507864 | 0.91 | — | — | |
| SCHEMBL6663234 | 0.91 | TSHR (0.42) | — | |
| Water SCHEMBL27957852 | 0.86 | TSHR (0.39) | — | |
| Hydrochloric Acid SCHEMBL31083666 | 0.86 | — | — | |
| Methane SCHEMBL9178014 | 0.82 | TSHR (0.36) | — | |
| Iodide SCHEMBL1567793 | 0.73 | — | — | |
| Iodide SCHEMBL27531970 | 0.73 | — | — | |
| Iodide SCHEMBL1566628 | 0.73 | — | — | |
| SCHEMBL23925387 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-108101792-B | Synthetic method of diaminopropylamine copper iodide perovskite photoelectric material | 福建江夏学院 | 2020-10-16 | — | — | CN | claimed |
| CN-108101792-B | Synthetic method of diaminopropylamine copper iodide perovskite photoelectric material | 福建江夏学院 | 2020-10-16 | — | — | CN | disclosed |
| CN-108101792-B | Synthetic method of diaminopropylamine copper iodide perovskite photoelectric material | 福建江夏学院 | 2020-10-16 | — | — | CN | disclosed |