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 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6298876 | 0.97 | CYP2D6 (0.39) | CYP2D6 | |
| SCHEMBL366099 | 0.76 | — | — | |
| SCHEMBL21531949 | 0.73 | CYP2D6 (0.41) | CYP2D6 | |
| Ammonia Solution, Strong SCHEMBL23111276 | 0.73 | CYP2D6 (0.41) | CYP2D6 | |
| Hydrochloric Acid SCHEMBL20590094 | 0.73 | CYP2D6 (0.41) | CYP2D6 | |
| Hydrochloric Acid SCHEMBL2316396 | 0.73 | CYP2D6 (0.41) | CYP2D6 | |
| Bromide SCHEMBL25379360 | 0.73 | CYP2D6 (0.41) | CYP2D6 | |
| SCHEMBL28470665 | 0.73 | CYP2D6 (0.41) | CYP2D6 | |
| SCHEMBL4135812 | 0.73 | — | — | |
| SCHEMBL20863059 | 0.71 | CYP2D6 (0.54) | CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010065128-A1 | AMORPHOUS ACIDIC MATERIALS, THEIR SYNTHESIS AND USE | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) | 2010-06-10 | — | — | WO | disclosed |