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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 8/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.36 |
| ▸ | HTR2A | P28223 | 4/20 | 0.36 |
| ▸ | HTR2B | P41595 | 2/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | HTR3A | P46098 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL299620 | 0.98 | — | — | |
| Bromide SCHEMBL28138303 | 0.96 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3HTR2AHTR2B | |
| Ammonia Solution, Strong SCHEMBL462091 | 0.96 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3HTR2AHTR2B | |
| Hydrochloric Acid SCHEMBL7127201 | 0.96 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3HTR2AHTR2B | |
| Acrylamide SCHEMBL11341611 | 0.85 | ADRA2C (0.37) | SLC6A2SLC6A4SLC6A3HTR2AHTR2B | |
| SCHEMBL16767730 | 0.82 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3HTR2AHTR2B | |
| SCHEMBL27749185 | 0.80 | HTR1D (0.35) | SLC6A2SLC6A4SLC6A3HTR2AHTR2B | |
| SCHEMBL400952 | 0.79 | — | — | |
| SCHEMBL5941067 | 0.79 | ADRB2 (0.31) | SLC6A2SLC6A4SLC6A3HTR2AHTR2B | |
| SCHEMBL15173596 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109503657-B | Synthesis method of 4-dihydrocarbyloxyphosphono-2-methyl-2-butenoic acid alkyl ester | 浙江新和成股份有限公司 | 2021-03-02 | — | — | CN | claimed |