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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BDKRB2 | P30411 | 6/20 | 0.61 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | DNM1 | Q05193 | 3/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL5087228 | 0.98 | BDKRB2 (0.59) | BDKRB2CSNK1EKCNH2DNM1MEN1 | |
| Iodide SCHEMBL5091551 | 0.98 | BDKRB2 (0.59) | BDKRB2CSNK1EKCNH2DNM1MEN1 | |
| Iodide SCHEMBL5088222 | 0.98 | BDKRB2 (0.59) | BDKRB2CSNK1EKCNH2DNM1MEN1 | |
| Iodide SCHEMBL3861081 | 0.98 | BDKRB2 (0.59) | BDKRB2CSNK1EKCNH2DNM1MEN1 | |
| Iodide SCHEMBL5087915 | 0.98 | BDKRB2 (0.59) | BDKRB2CSNK1EKCNH2DNM1MEN1 | |
| Iodide SCHEMBL5088210 | 0.98 | BDKRB2 (0.59) | BDKRB2CSNK1EKCNH2DNM1MEN1 | |
| Iodide SCHEMBL3857563 | 0.98 | BDKRB2 (0.59) | BDKRB2CSNK1EKCNH2DNM1MEN1 | |
| Iodide SCHEMBL5092116 | 0.98 | BDKRB2 (0.59) | BDKRB2CSNK1EKCNH2DNM1MEN1 | |
| Iodide SCHEMBL5088352 | 0.98 | BDKRB2 (0.59) | BDKRB2CSNK1EKCNH2DNM1MEN1 | |
| Bromide SCHEMBL5092919 | 0.96 | BDKRB2 (0.67) | BDKRB2CSNK1EKCNH2DNM1SIGMAR1 |
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-20080214386-A1 | Stability; easily separated from solution; surface treatment of catalyst with Group seven compound; reacting epoxide with carbon dioxide | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2008-09-04 | — | — | US | disclosed |