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 | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.47 |
| ▸ | SCNN1A | P37088 | 9/20 | 0.42 |
| ▸ | DRD5 | P21918 | 1/20 | 0.42 |
| ▸ | SCNN1B | P51168 | 1/20 | 0.42 |
| ▸ | SCNN1G | P51170 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | GLA | P06280 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | THPO | P40225 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12636682 | 0.99 | KCNH2 (0.48) | KCNH2SCNN1ADRD5SCNN1BSCNN1G | |
| Iodide SCHEMBL2020004 | 0.90 | SCNN1A (0.44) | KCNH2SCNN1ADRD5SCNN1BSCNN1G | |
| SCHEMBL2020727 | 0.89 | SCNN1A (0.46) | KCNH2SCNN1ADRD5SCNN1BSCNN1G | |
| SCHEMBL12635781 | 0.89 | SCNN1A (0.44) | KCNH2SCNN1ADRD5SCNN1BSCNN1G | |
| Iodide SCHEMBL2017223 | 0.89 | SCNN1A (0.44) | KCNH2SCNN1ADRD5SCNN1BSCNN1G | |
| SCHEMBL12636698 | 0.88 | SCNN1A (0.45) | KCNH2SCNN1ADRD5SCNN1BSCNN1G | |
| Iodide SCHEMBL2043292 | 0.88 | SCNN1A (0.44) | KCNH2SCNN1ADRD5SCNN1BSCNN1G | |
| Iodide SCHEMBL2015067 | 0.87 | SCNN1A (0.43) | KCNH2SCNN1ADRD5SCNN1BSCNN1G | |
| SCHEMBL12636291 | 0.87 | SCNN1A (0.45) | KCNH2SCNN1ADRD5SCNN1BSCNN1G | |
| SCHEMBL12635780 | 0.86 | SCNN1A (0.44) | KCNH2SCNN1ADRD5SCNN1BSCNN1G |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011079087-A1 | ENAC BLOCKERS | GLAXO GROUP LIMITED (GB) | 2011-06-30 | — | — | WO | claimed |
| WO-2011079087-A1 | ENAC BLOCKERS | GLAXO GROUP LIMITED (GB) | 2011-06-30 | — | — | WO | disclosed |