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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | GBA2 | Q9HCG7 | 16/20 | 0.38 |
| ▸ | GBA1 | P04062 | 10/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL8914113 | 0.93 | MEN1 (0.39) | MEN1THRBHTTKMT2AMAPT | |
| Iodide SCHEMBL5088508 | 0.86 | GUSB (0.37) | THRBHTTALDH1A1 | |
| Iodide SCHEMBL2125638 | 0.86 | GUSB (0.37) | THRBHTTALDH1A1 | |
| Iodide SCHEMBL5085010 | 0.86 | GUSB (0.37) | THRBHTTALDH1A1 | |
| Iodide SCHEMBL5087913 | 0.86 | GUSB (0.37) | THRBHTTALDH1A1 | |
| Iodide SCHEMBL1758284 | 0.86 | GUSB (0.37) | THRBHTTALDH1A1 | |
| Iodide SCHEMBL594562 | 0.86 | GUSB (0.37) | THRBHTTALDH1A1 | |
| Iodide SCHEMBL5091920 | 0.86 | GUSB (0.37) | THRBHTTALDH1A1 | |
| Iodide SCHEMBL5087102 | 0.86 | GUSB (0.37) | THRBHTTALDH1A1 | |
| SCHEMBL14890270 | 0.85 | GBA2 (0.36) | MEN1THRBHTTKMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5614548-A | TREATING TUMORS AND HIV INFECTION, PROTEIN KINASE C INHIBITORS | WAKE FOREST UNIVERSITY (US) | 1997-03-25 | — | — | US | disclosed |
| WO-1990004918-A2 | QUATERNARY AMINE CONTAINING ETHER OR ESTER LIPID DERIVATIVES AND THERAPEUTIC COMPOSITIONS | WAKE FOREST UNIVERSITY (US) | 1990-05-17 | — | — | WO | disclosed |