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 | |
|---|---|---|---|---|
| ▸ | DGKA | P23743 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | PAM | P19021 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 3/20 | 0.43 |
| ▸ | CES1 | P23141 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.42 |
| ▸ | NAAA | Q02083 | 1/20 | 0.42 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.42 |
| ▸ | PPARG | P37231 | 2/20 | 0.42 |
| ▸ | PPARD | Q03181 | 2/20 | 0.42 |
| ▸ | PPARA | Q07869 | 2/20 | 0.42 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.42 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.42 |
| ▸ | TLR2 | O60603 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7793662 | 0.98 | DGKA (0.52) | DGKALMNAPAMALDH1A1MAPT | |
| Iodide SCHEMBL21645932 | 0.86 | DGKA (0.64) | DGKALMNAPAMALDH1A1MAPT | |
| SCHEMBL4446360 | 0.85 | DGKA (0.53) | DGKALMNAPAMALDH1A1MAPT | |
| SCHEMBL3918186 | 0.85 | DGKA (0.53) | DGKALMNAPAMALDH1A1MAPT | |
| SCHEMBL2898744 | 0.85 | DGKA (0.53) | DGKALMNAPAMALDH1A1MAPT | |
| Dodecanoic Anhydride SCHEMBL468394 | 0.84 | DGKA (0.67) | DGKALMNAPAMALDH1A1MAPT | |
| SCHEMBL15527970 | 0.84 | DGKA (0.67) | DGKALMNAPAMALDH1A1MAPT | |
| SCHEMBL8584840 | 0.84 | DGKA (0.67) | DGKALMNAPAMALDH1A1MAPT | |
| SCHEMBL7154415 | 0.84 | DGKA (0.67) | DGKALMNAPAMALDH1A1MAPT | |
| SCHEMBL11577267 | 0.84 | DGKA (0.67) | DGKALMNAPAMALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-7078402-B2 | Aminothiol ester compounds, pharmaceutical and cosmetics compositions containing same and uses thereof | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) | 2006-07-18 | — | — | US | claimed |