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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH3 | Q9ULD8 | 2/20 | 0.62 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 3/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.53 |
| ▸ | PTPRF | P10586 | 1/20 | 0.53 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.53 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL2093541 | 0.98 | KCNH3 (0.64) | KCNH3MEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL4241915 | 0.89 | HTT (0.64) | KCNH3CYP1A2POLBGAAL3MBTL1 | |
| SCHEMBL10055033 | 0.87 | LMNA (0.61) | KCNH3MEN1KMT2APOLBGAA | |
| SCHEMBL6419238 | 0.87 | LMNA (0.61) | KCNH3MEN1KMT2APOLBGAA | |
| SCHEMBL2065031 | 0.87 | CYP1A2 (0.69) | MEN1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL11510992 | 0.86 | FFAR1 (0.63) | KCNH3MEN1KMT2AGAAL3MBTL1 | |
| Propionic Acid SCHEMBL11468427 | 0.84 | FFAR1 (0.59) | KCNH3MEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL6692354 | 0.83 | PPARA (0.54) | KCNH3MEN1KMT2AMAOB | |
| SCHEMBL22628164 | 0.82 | HTT (0.71) | KCNH3MEN1CYP1A2CYP3A4CYP2C9 | |
| N-Benzylaniline SCHEMBL7840 | 0.82 | HTT (0.71) | KCNH3MEN1CYP1A2CYP3A4CYP2C9 |
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-116406213-A | Chemical method for inhibiting ion diffusion in perovskite battery | 华东理工大学 | 2023-07-07 | — | — | CN | claimed |