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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC2A1 | P11166 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | SCN4A | P35499 | 2/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.42 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL22570767 | 0.98 | SLC2A1 (0.50) | SLC2A1POLBKDM4EALDH1A1CA2 | |
| SCHEMBL4851319 | 0.98 | SLC2A1 (0.50) | SLC2A1POLBKDM4EALDH1A1CA2 | |
| SCHEMBL453579 | 0.98 | SLC2A1 (0.50) | SLC2A1POLBKDM4EALDH1A1CA2 | |
| Hydrochloric Acid SCHEMBL2913067 | 0.96 | SLC2A1 (0.53) | SLC2A1POLBKDM4EALDH1A1CA2 | |
| SCHEMBL869237 | 0.92 | SLC2A1 (0.57) | SLC2A1CA2SCN4AHTR2AHRH1 | |
| SCHEMBL13132265 | 0.92 | SLC2A1 (0.57) | SLC2A1CA2SCN4AHTR2AHRH1 | |
| Hydrochloric Acid SCHEMBL4937477 | 0.90 | SLC2A1 (0.60) | SLC2A1CA2SCN4AHTR2AHRH1 | |
| SCHEMBL4990564 | 0.90 | SLC2A1 (0.60) | SLC2A1CA2HTR2ACSNK1E | |
| SCHEMBL10589876 | 0.90 | SLC2A1 (0.60) | SLC2A1CA2HTR2ACSNK1E | |
| SCHEMBL4071245 | 0.90 | SLC2A1 (0.60) | SLC2A1CA2HTR2ACSNK1E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013163532-A1 | POLYMERIZABLE COMPOSITIONS CONTAINING ETHYLENICALLY UNSATURATED MONOMERS HAVING EPISULFIDE FUNCTIONAL GROUPS AND RELATED METHODS | PPG INDUSTRIES OHIO, INC. (US) | 2013-10-31 | — | — | WO | disclosed |
| WO-2008089051-A1 | N-SUBSTITUTED GLYCINE DERIVATIVES: PROLYL HYDROXYLASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-07-24 | — | — | WO | disclosed |
| US-20040122201-A1 | polysulfides; improved impact resistance | MITSUBISHI GAS CHEMICAL COMPANY (JP) | 2004-06-24 | — | — | US | disclosed |