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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | PTAFR | P25105 | 1/20 | 0.41 |
| ▸ | HTR1D | P28221 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.41 |
| ▸ | PLA2G2C | Q5R387 | 3/20 | 0.40 |
| ▸ | PRKCA | P17252 | 2/20 | 0.36 |
| ▸ | TLR2 | O60603 | 2/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.34 |
| ▸ | LPAR3 | Q9UBY5 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
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 SCHEMBL8913708 | 0.84 | PRKD3 (0.43) | PRKCALPAR1LPAR3USP2 | |
| Iodide SCHEMBL8914063 | 0.82 | PRKCA (0.34) | PRKCACES2 | |
| Iodide SCHEMBL8913281 | 0.82 | USP2 (0.48) | PLA2G2CLPAR1LPAR3USP2 | |
| Iodide SCHEMBL8913962 | 0.80 | PLA2G2C (0.43) | ADRA1DPTAFRHTR1DHTR2CADRA1B | |
| Bromide SCHEMBL9575823 | 0.73 | AKT1 (0.38) | PLA2G2CTLR2 | |
| Iodide SCHEMBL8914391 | 0.73 | MEN1 (0.37) | — | |
| Iodide SCHEMBL10821731 | 0.73 | MEN1 (0.37) | — | |
| Iodide SCHEMBL10821548 | 0.73 | MEN1 (0.37) | — | |
| Iodide SCHEMBL10821820 | 0.73 | MEN1 (0.37) | — | |
| Iodide SCHEMBL10822289 | 0.73 | MEN1 (0.37) | — |
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-1990004918-A2 | QUATERNARY AMINE CONTAINING ETHER OR ESTER LIPID DERIVATIVES AND THERAPEUTIC COMPOSITIONS | WAKE FOREST UNIVERSITY (US) | 1990-05-17 | — | — | WO | disclosed |