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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 5/20 | 0.37 |
| ▸ | MTNR1B | P49286 | 5/20 | 0.37 |
| ▸ | NPC1 | O15118 | 5/20 | 0.37 |
| ▸ | RAB9A | P51151 | 5/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | LTA4H | P09960 | 1/20 | 0.34 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
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 SCHEMBL9407569 | 0.90 | KMT2A (0.34) | MEN1KMT2AMAPTL3MBTL1MTNR1A | |
| Iodide SCHEMBL9407534 | 0.89 | KMT2A (0.38) | MEN1KMT2AMAPTMTNR1AMTNR1B | |
| Hydrochloric Acid SCHEMBL9407490 | 0.88 | KMT2A (0.34) | MEN1KMT2AMAPTL3MBTL1MTNR1A | |
| Hydrochloric Acid SCHEMBL9407578 | 0.87 | KMT2A (0.38) | MEN1KMT2AMAPTMTNR1AMTNR1B | |
| SCHEMBL9525317 | 0.87 | KDM4E (0.39) | MEN1KMT2A | |
| Iodide SCHEMBL9407503 | 0.87 | KMT2A (0.34) | MEN1KMT2AMAPTL3MBTL1MTNR1A | |
| Hydrochloric Acid SCHEMBL9525253 | 0.86 | MEN1 (0.33) | MEN1KMT2AMAPTMTNR1AMTNR1B | |
| Iodide SCHEMBL9528194 | 0.86 | NPC1 (0.43) | MEN1KMT2AMAPTMTNR1AMTNR1B | |
| Iodide SCHEMBL9526189 | 0.85 | ALDH1A1 (0.41) | MEN1KMT2AMAPTL3MBTL1NPC1 | |
| Iodide SCHEMBL9407542 | 0.84 | GPBAR1 (0.33) | MEN1KMT2AMAPTMTNR1AMTNR1B |
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-0301751-B1 | PYRIDINIUM DERIVATIVES, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1993-03-10 | — | — | EP | disclosed |
| US-4962113-A | PLATELET ACTIVATING FACTOR ANTAGONISTS | TAKEDA CHEMICAL INDUSTRIES, LTD (JP) | 1990-10-09 | — | — | US | disclosed |