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 | |
|---|---|---|---|---|
| ▸ | CHRM1 known ✓ | P11229 | 2/20 | 0.66 |
| ▸ | ACHE known ✓ | P22303 | 2/20 | 0.66 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.63 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.66 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.66 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.66 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.66 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.66 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.66 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.66 |
| ▸ | ESR1 | P03372 | 1/20 | 0.66 |
| ▸ | PGR | P06401 | 1/20 | 0.66 |
| ▸ | HTR1A | P08908 | 1/20 | 0.66 |
| ▸ | DRD1 | P21728 | 1/20 | 0.66 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.66 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.66 |
| ▸ | PDE4A | P27815 | 1/20 | 0.66 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.66 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.66 |
| ▸ | DRD3 | P35462 | 1/20 | 0.66 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL28757895 | 0.96 | ACHE (0.69) | CHRM2ADRA2AADORA3CHRM1ACHE | |
| SCHEMBL4895340 | 0.91 | ACHE (0.62) | CHRM2ADRA2AADORA3CHRM1ACHE | |
| SCHEMBL5818672 | 0.91 | ACHE (0.62) | CHRM2ADRA2AADORA3CHRM1ACHE | |
| SCHEMBL23198628 | 0.91 | ACHE (0.61) | CHRM2ADRA2AADORA3CHRM1ACHE | |
| SCHEMBL12484757 | 0.91 | ACHE (0.61) | CHRM2ADRA2AADORA3CHRM1ACHE | |
| Hydrochloric Acid SCHEMBL28434704 | 0.89 | KMT2A (0.63) | CHRM2ADRA2AADORA3CHRM1ACHE | |
| Hydrochloric Acid SCHEMBL2837787 | 0.89 | KMT2A (0.62) | CHRM2ADRA2AADORA3CHRM1ACHE | |
| Hydrochloric Acid SCHEMBL2209795 | 0.87 | KMT2A (0.60) | CHRM2ADRA2AADORA3CHRM1ACHE | |
| SCHEMBL5823113 | 0.85 | ACHE (0.70) | CHRM2ADRA2AADORA3CHRM1ACHE | |
| SCHEMBL28920956 | 0.84 | ACHE (0.53) | CHRM2ADRA2AADORA3CHRM1ACHE |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016092499-A1 | AN IMPROVED PROCESS FOR THE PRODUCTION OF QUATERNARY PYRIDINIUM SALTS | JUBILANT LIFE SCIENCES LIMITED (IN) | 2016-06-16 | — | — | WO | disclosed |