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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 known ✓ | P11229 | 16/20 | 0.55 |
| ▸ | CHRM3 known ✓ | P20309 | 16/20 | 0.55 |
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 16/20 | 0.55 |
| ▸ | BCHE | P06276 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.47 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | RGS12 | O14924 | 1/20 | 0.47 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.47 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.47 |
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 SCHEMBL1924830 | 1.00 | CHRM2 (0.55) | CHRM2CHRM1CHRM3BCHEACHE | |
| SCHEMBL1926671 | 0.99 | CHRM2 (0.56) | CHRM2CHRM1CHRM3BCHEACHE | |
| SCHEMBL1926669 | 0.99 | CHRM2 (0.56) | CHRM2CHRM1CHRM3BCHEACHE | |
| Iodide SCHEMBL1925324 | 0.89 | CHRM2 (0.56) | CHRM2CHRM1CHRM3BCHEACHE | |
| Iodide SCHEMBL1925322 | 0.89 | CHRM2 (0.56) | CHRM2CHRM1CHRM3BCHEACHE | |
| SCHEMBL1925466 | 0.88 | CHRM2 (0.56) | CHRM2CHRM1CHRM3BCHEACHE | |
| SCHEMBL1925463 | 0.88 | CHRM2 (0.56) | CHRM2CHRM1CHRM3BCHEACHE | |
| Iodide SCHEMBL1925665 | 0.86 | CHRM2 (0.71) | CHRM2CHRM1CHRM3BCHEACHE | |
| Iodide SCHEMBL1925662 | 0.86 | CHRM2 (0.71) | CHRM2CHRM1CHRM3BCHEACHE | |
| SCHEMBL1924968 | 0.85 | CHRM2 (0.72) | CHRM2CHRM1CHRM3 |
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-1300407-B2 | CARBAMATES DERIVED FROM ARYLALKYLAMINES | S A L V A T LAB SA (ES) | 2011-06-08 | — | — | EP | claimed |
| EP-1300407-B2 | CARBAMATES DERIVED FROM ARYLALKYLAMINES | S A L V A T LAB SA (ES) | 2011-06-08 | — | — | EP | disclosed |