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 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.49 |
| ▸ | CHKA | P35790 | 13/20 | 0.61 |
| ▸ | BCHE | P06276 | 1/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | NCF1 | P14598 | 1/20 | 0.43 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.43 |
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 SCHEMBL15212150 | 0.90 | CHKA (0.59) | CHKABCHEACHE | |
| Hydrochloric Acid SCHEMBL9328059 | 0.90 | CHKA (0.59) | CHKABCHEACHE | |
| Iodide SCHEMBL15212342 | 0.89 | CHKA (0.59) | CHKABCHEACHE | |
| SCHEMBL9328178 | 0.88 | CHKA (0.61) | CHKABCHEACHE | |
| Iodide SCHEMBL15211901 | 0.86 | CHKA (0.56) | CHKABCHEACHE | |
| Bromide SCHEMBL9327138 | 0.86 | CHKA (0.65) | CHKABCHEACHE | |
| SCHEMBL9329679 | 0.86 | CHKA (0.62) | CHKABCHEACHE | |
| Water SCHEMBL15211988 | 0.86 | CHKA (0.59) | CHKABCHEACHE | |
| Bromide SCHEMBL9327388 | 0.84 | CHKA (0.66) | CHKABCHEACHE | |
| Iodide SCHEMBL15212390 | 0.81 | CHKA (0.68) | CHKABCHEACHEADRB2NCF1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2817262-A1 | MOLECULAR SIEVE MATERIAL, ITS SYNTHESIS AND USE | ExxonMobil Chemical Patents Inc. (US) | 2014-12-31 | — | — | EP | disclosed |
| WO-2013126140-A1 | MOLECULAR SIEVE MATERIAL, ITS SYNTHESIS AND USE | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2013-08-29 | — | — | WO | disclosed |