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 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 5/20 | 0.33 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL361078 | 0.96 | ACHE (0.34) | ACHEBBOX1TSHR | |
| Hydrochloric Acid SCHEMBL142822 | 0.93 | ACHE (0.33) | ACHEBBOX1TSHR | |
| Ammonia Solution, Strong SCHEMBL6558011 | 0.93 | ACHE (0.33) | ACHEBBOX1TSHR | |
| Water SCHEMBL5407242 | 0.93 | ACHE (0.33) | ACHEBBOX1TSHR | |
| Fluoride Ion SCHEMBL6689085 | 0.93 | ACHE (0.33) | ACHEBBOX1TSHR | |
| Bromide SCHEMBL4276591 | 0.93 | ACHE (0.37) | ACHEBBOX1TSHR | |
| Hydrochloric Acid SCHEMBL7045853 | 0.84 | ACHE (0.30) | ACHEBBOX1 | |
| Iodide SCHEMBL14890442 | 0.84 | TSHR (0.32) | ACHEBBOX1TSHR | |
| SCHEMBL17428422 | 0.83 | BBOX1 (0.37) | ACHEBBOX1 | |
| Bicarbonate SCHEMBL5407654 | 0.82 | BBOX1 (0.42) | ACHEBBOX1TSHR |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109880004-A | The preparation method of high molecular weight polypropylene acyloxyethyl trimethyl ammonium chloride | 南京理工大学 | 2019-06-14 | — | — | CN | claimed |
| CN-109749014-A | The preparation method of high feature viscosity polymethacrylamide hydroxypropyltrimonium chloride | 南京理工大学 | 2019-05-14 | — | — | CN | claimed |
| CN-109880004-B | Preparation method of high relative molecular mass polyacrylic acyl oxyethyl trimethyl ammonium chloride | 南京理工大学 | 2021-06-11 | — | — | CN | disclosed |
| CN-109749014-B | Preparation method of polymethacrylamidopropyltrimethylammonium chloride with high characteristic viscosity | 南京理工大学 | 2021-04-27 | — | — | CN | disclosed |
| CN-109880004-A | The preparation method of high molecular weight polypropylene acyloxyethyl trimethyl ammonium chloride | 南京理工大学 | 2019-06-14 | — | — | CN | disclosed |
| CN-109749014-A | The preparation method of high feature viscosity polymethacrylamide hydroxypropyltrimonium chloride | 南京理工大学 | 2019-05-14 | — | — | CN | disclosed |