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 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.31 |
| ▸ | CTRC | Q99895 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6831030 | 0.98 | GABRA1 (0.32) | GABRA1GABRB2CTRC | |
| Bromide SCHEMBL5085462 | 0.95 | GABRA1 (0.31) | GABRA1GABRB2CTRC | |
| Hydrochloric Acid SCHEMBL2965190 | 0.95 | GABRA1 (0.31) | GABRA1GABRB2CTRC | |
| SCHEMBL166573 | 0.82 | GABRA1 (0.41) | GABRA1GABRB2CTRC | |
| SCHEMBL29619533 | 0.82 | GABRA1 (0.41) | GABRA1GABRB2CTRC | |
| Bromide SCHEMBL8559533 | 0.80 | — | — | |
| Ammonia Solution, Strong SCHEMBL27539208 | 0.79 | GABRA1 (0.39) | GABRA1GABRB2CTRC | |
| Ethylene SCHEMBL27502363 | 0.76 | GABRA1 (0.38) | GABRA1GABRB2CTRC | |
| Iodide SCHEMBL11880554 | 0.76 | NOS3 (0.38) | — | |
| SCHEMBL231467 | 0.76 | GABRA1 (0.46) | GABRA1GABRB2 |
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 |