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 | |
|---|---|---|---|---|
| SCHEMBL4788215 | 0.98 | — | — | |
| Bromide SCHEMBL27835668 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL28369527 | 0.74 | — | — | |
| SCHEMBL5436582 | 0.72 | — | — | |
| SCHEMBL28556617 | 0.71 | GABRR1 (0.33) | — | |
| Formic Acid SCHEMBL27695964 | 0.71 | — | — | |
| SCHEMBL19212544 | 0.71 | — | — | |
| Iodide SCHEMBL28445795 | 0.70 | — | — | |
| Iodide SCHEMBL26646446 | 0.70 | — | — | |
| SCHEMBL28885791 | 0.69 | — | — |
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-103097395-B | Platinum (II) tetradentate ONCN complex for organic light-emitting diode | VERSITECH LTD. (CN) | 2015-09-16 | — | — | CN | disclosed |
| CN-103097395-A | Platinum (II) tetradentate ONCN complex for organic light-emitting diode | VERSITECH LTD | 2013-05-08 | — | — | CN | disclosed |