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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 17/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30865862 | 0.99 | AR (0.46) | ARNOTUMPDE3BPDE3APIK3CA | |
| Hydrochloric Acid SCHEMBL30865856 | 0.77 | POLB (0.36) | — | |
| Trifluoroacetic Acid SCHEMBL30141151 | 0.75 | GPR6 (0.33) | — | |
| SCHEMBL28084107 | 0.67 | LMNA (0.51) | ARNOTUM | |
| SCHEMBL13485856 | 0.67 | COMT (0.55) | ARNOTUM | |
| Iodide SCHEMBL1845139 | 0.66 | AR (0.39) | ARPIK3CA | |
| SCHEMBL10475073 | 0.64 | AR (0.43) | AR | |
| SCHEMBL5906245 | 0.64 | AR (0.49) | ARNOTUM | |
| SCHEMBL15642776 | 0.64 | AR (0.52) | ARNOTUM | |
| SCHEMBL21792323 | 0.64 | NOTUM (0.70) | ARNOTUM |
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 |
|---|---|---|---|---|---|---|---|
| EP-2911669-B1 | SYNERGISTIC COMBINATION OF IMMUNOLOGIC INHIBITORS FOR THE TREATMENT OF CANCER | UNIV CHICAGO (US) | 2024-04-10 | — | — | EP | disclosed |