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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.32 |
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.32 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | SCN1A | P35498 | 1/20 | 0.30 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.30 |
| ▸ | SCN3A | Q9NY46 | 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 | |
|---|---|---|---|---|
| SCHEMBL1277086 | 0.98 | BCHE (0.33) | CHRNB4CHRNA3CHRNA7BCHEACHE | |
| SCHEMBL15908308 | 0.98 | BCHE (0.33) | CHRNB4CHRNA3CHRNA7BCHEACHE | |
| SCHEMBL15908311 | 0.98 | BCHE (0.33) | CHRNB4CHRNA3CHRNA7BCHEACHE | |
| Bromide SCHEMBL29201326 | 0.95 | CHRM4 (0.35) | CHRNB4CHRNA3CHRNA7BCHEACHE | |
| Hydrochloric Acid SCHEMBL29201358 | 0.95 | BCHE (0.32) | CHRNB4CHRNA3CHRNA7BCHEACHE | |
| Iodide SCHEMBL30354174 | 0.91 | CHRNB4 (0.38) | CHRNB4CHRNA3CHRNA7BCHEACHE | |
| SCHEMBL1277026 | 0.90 | — | — | |
| Iodide SCHEMBL16209990 | 0.88 | CA2 (0.33) | CA2 | |
| SCHEMBL16674081 | 0.88 | CHRM1 (0.36) | CHRNB4CHRNA3CHRNA7BCHEACHE | |
| Iodide SCHEMBL1408228 | 0.85 | CHRNB4 (0.38) | CHRNB4CHRNA3CHRNA7CHRM4CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117813334-A | Onium salt, blocking agent dissociation catalyst for blocking isocyanate, blocked isocyanate composition containing blocking agent dissociation catalyst, thermosetting resin composition, cured product, and method for producing same | 广荣化学株式会社 | 2024-04-02 | — | — | CN | disclosed |