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 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.31 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.31 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
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 SCHEMBL8953826 | 1.00 | CHRNA7 (0.33) | CHRNA7CHRM2CHRM4CHRM5CYP2D6 | |
| SCHEMBL19307655 | 0.97 | CHRNA7 (0.34) | CHRNA7CHRM2CHRM4CHRM5CYP2D6 | |
| SCHEMBL2865219 | 0.97 | CHRNA7 (0.34) | CHRNA7CHRM2CHRM4CHRM5CYP2D6 | |
| SCHEMBL575098 | 0.97 | CHRNA7 (0.34) | CHRNA7CHRM2CHRM4CHRM5CYP2D6 | |
| SCHEMBL19307694 | 0.97 | CHRNA7 (0.34) | CHRNA7CHRM2CHRM4CHRM5CYP2D6 | |
| Bromide SCHEMBL8953751 | 0.93 | CHRNA7 (0.33) | CHRNA7CHRM2CHRM4CHRM5CYP2D6 | |
| Water SCHEMBL22772155 | 0.93 | CHRNA7 (0.33) | CHRNA7CHRM2CHRM4CHRM5CYP2D6 | |
| Iodide SCHEMBL9055249 | 0.93 | CHRNA7 (0.33) | CHRNA7CHRM2CHRM4CHRM5CYP2D6 | |
| Water SCHEMBL10941646 | 0.93 | CHRNA7 (0.33) | CHRNA7CHRM2CHRM4CHRM5CYP2D6 | |
| SCHEMBL9752179 | 0.93 | CHRNA7 (0.33) | CHRNA7CHRM2CHRM4CHRM5CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0628585-B1 | Advancement catalyst containing epoxy resin compositions | CIBA GEIGY (CH) | 1997-06-04 | — | — | EP | claimed |
| US-5521261-A | PERHYDROAZEPINIUM OR OCTAHYDROAZOCINIUM SALT FOR CHAIN EXTENSION | CIBA-GEIGY CORPORATION (US) | 1996-05-28 | — | — | US | claimed |
| US-5521261-A | PERHYDROAZEPINIUM OR OCTAHYDROAZOCINIUM SALT FOR CHAIN EXTENSION | CIBA-GEIGY CORPORATION (US) | 1996-05-28 | — | — | US | disclosed |