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 | 0.70 |
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.49 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.49 |
| ▸ | HRH2 | P25021 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.49 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | ATP4A | P20648 | 1/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
| ▸ | ATP4B | P51164 | 1/20 | 0.49 |
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 SCHEMBL8743615 | 1.00 | ACHE (0.70) | ACHEHRH2MEN1KMT2ASLC22A1 | |
| Bromide SCHEMBL8943992 | 0.98 | ACHE (0.70) | ACHEHRH2MEN1KMT2ASLC22A1 | |
| Hydrochloric Acid SCHEMBL8743613 | 0.98 | ACHE (0.70) | ACHEHRH2MEN1KMT2ASLC22A1 | |
| Bromide SCHEMBL8943986 | 0.98 | ACHE (0.70) | ACHEHRH2MEN1KMT2ASLC22A1 | |
| Hydrochloric Acid SCHEMBL8743609 | 0.98 | ACHE (0.70) | ACHEHRH2MEN1KMT2ASLC22A1 | |
| Bromide SCHEMBL8944145 | 0.89 | ACHE (0.59) | ACHEHRH2MEN1KMT2ASLC22A1 | |
| Bromide SCHEMBL8944142 | 0.89 | ACHE (0.59) | ACHEHRH2MEN1KMT2ASLC22A1 | |
| SCHEMBL11228575 | 0.87 | ACHE (0.72) | ACHEHRH2MEN1KMT2ASLC22A1 | |
| SCHEMBL11228578 | 0.87 | ACHE (0.72) | ACHEHRH2MEN1KMT2ASLC22A1 | |
| SCHEMBL11227952 | 0.86 | ACHE (0.71) | ACHEHRH2MEN1KMT2ASLC22A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0641763-B1 | NOVEL QUATERNARY AMMONIUM SALTS AND USE THEREOF AS MEDICINE | ZERIA PHARM CO LTD (JP) | 1997-01-08 | — | — | EP | disclosed |
| US-5574054-A | GASTROINTESTINAL DISORDERS | ZERIA PHARMACEUTICAL CO., LTD. (JP) | 1996-11-12 | — | — | US | disclosed |