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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
| ▸ | NQO1 | P15559 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.31 |
| ▸ | RXRA | P19793 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 1/20 | 0.31 |
| ▸ | PPARD | Q03181 | 1/20 | 0.31 |
| ▸ | PPARA | Q07869 | 1/20 | 0.31 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL50100 | 0.86 | CYP1A2 (0.43) | ERBB2CYP1A2FYNMAOAACHE | |
| Ammonia Solution, Strong SCHEMBL8665916 | 0.84 | CYP1A2 (0.42) | ERBB2CYP1A2FYNMAOAACHE | |
| Trimethylammonium SCHEMBL5191404 | 0.83 | CYP1A2 (0.39) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL7572908 | 0.78 | HTR1B (0.36) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL16990771 | 0.77 | CYP1A2 (0.36) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL8651284 | 0.76 | TDP1 (0.43) | CYP1A2RXRAATMTDP1 | |
| Iodide SCHEMBL3454480 | 0.76 | CYP1A2 (0.40) | ERBB2CYP1A2FYNMAOAACHE | |
| Tetrahydrofuran SCHEMBL8033535 | 0.76 | CYP1A2 (0.35) | ERBB2CYP1A2FYNMAOAACHE | |
| Iodide SCHEMBL21834093 | 0.75 | THRA (0.35) | ALOX5TDP1 | |
| Biphenyl SCHEMBL9409544 | 0.75 | NQO1 (0.36) | ERBB2CYP1A2FYNMAOAACHE |
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-3853026-B1 | LITHOGRAPHIC PRINTING PLATE PRECURSOR AND COLOR-FORMING COMPOSITION | EASTMAN KODAK CO (US) | 2023-05-31 | — | — | EP | disclosed |
| US-20200096865-A1 | LITHOGRAPHIC PRINTING PLATE PRECURSOR AND COLOR-FORMING COMPOSITION | BANK OF AMERICA, N.A., AS AGENT | 2020-03-26 | — | — | US | disclosed |