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.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 7/20 | 0.98 |
| ▸ | APP | P05067 | 3/20 | 0.98 |
| ▸ | SNCA | P37840 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | THRB | P10828 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 2/20 | 0.45 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.45 |
| ▸ | VDR | P11473 | 4/20 | 0.44 |
| ▸ | MMP14 | P50281 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ALPG | P10696 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| Iodide SCHEMBL28572938 | 1.00 | MAPT (0.98) | MAPTAPPSNCAALDH1A1MEN1 | |
| SCHEMBL13235687 | 0.98 | MAPT (1.00) | MAPTAPPSNCAALDH1A1MEN1 | |
| SCHEMBL13235694 | 0.88 | MAPT (0.82) | MAPTAPPSNCAALDH1A1MEN1 | |
| SCHEMBL25664248 | 0.83 | MAPT (0.72) | MAPTAPPALDH1A1MEN1LMNA | |
| SCHEMBL13235689 | 0.81 | MAPT (0.71) | MAPTAPPSNCAALDH1A1MEN1 | |
| SCHEMBL13672216 | 0.81 | MAPT (0.71) | MAPTAPPSNCAALDH1A1MEN1 | |
| Iodide SCHEMBL6670545 | 0.79 | MAPT (0.66) | MAPTAPPSNCAALDH1A1MEN1 | |
| SCHEMBL13443027 | 0.78 | MAPT (0.63) | MAPTAPPALDH1A1MEN1LMNA | |
| SCHEMBL13766060 | 0.78 | MAPT (0.66) | MAPTAPPALDH1A1MEN1LMNA | |
| SCHEMBL13235738 | 0.77 | MAPT (0.62) | MAPTAPPSNCAALDH1A1MEN1 |
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-109953989-B | Pharmaceutical use of 2- (4-piperidylstyrene) -1,3, 3-trimethyl-3H-indolium iodide | 山东大学第二医院 | 2021-06-15 | — | — | CN | disclosed |
| CN-109953989-B | Pharmaceutical use of 2- (4-piperidylstyrene) -1,3, 3-trimethyl-3H-indolium iodide | 山东大学第二医院 | 2021-06-15 | — | — | CN | disclosed |