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 | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | RAF1 | P04049 | 1/20 | 0.41 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.41 |
| ▸ | THRA | P10827 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.40 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.40 |
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 SCHEMBL9308303 | 0.92 | ATM (0.40) | ATMRAF1MAP2K1NR1H4 | |
| Iodide SCHEMBL9307400 | 0.91 | MAPT (0.45) | TP53MAPTATMRAF1MAP2K1 | |
| Iodide SCHEMBL9307384 | 0.91 | TP53 (0.43) | TP53MAPTRAF1MAP2K1THRA | |
| Iodide SCHEMBL9306921 | 0.86 | TP53 (0.49) | TP53MAPTATMRAF1MAP2K1 | |
| Iodide SCHEMBL9308232 | 0.86 | TP53 (0.49) | TP53MAPTATMRAF1MAP2K1 | |
| Iodide SCHEMBL9306149 | 0.84 | RAF1 (0.50) | TP53MAPTRAF1MAP2K1NR1H4 | |
| Iodide SCHEMBL9306128 | 0.84 | LMNA (0.40) | MAPTATMRAF1MAP2K1NR1H4 | |
| Iodide SCHEMBL9308352 | 0.84 | LMNA (0.40) | MAPTATMRAF1MAP2K1NR1H4 | |
| Iodide SCHEMBL9307428 | 0.83 | MAPT (0.41) | TP53MAPTATMNR1H4THRA | |
| Iodide SCHEMBL9307453 | 0.83 | RAF1 (0.50) | TP53MAPTRAF1MAP2K1NR1H4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5328921-A | Antagonist of platelet activating factor | AMERICAN CYANAMID COMPANY (US) | 1994-07-12 | — | — | US | disclosed |