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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.34 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.34 |
| ▸ | PLK1 | P53350 | 2/20 | 0.33 |
| ▸ | MYC | P01106 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TACR3 | P29371 | 1/20 | 0.32 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.32 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28923016 | 0.99 | KMT2A (0.36) | KMT2AL3MBTL1MEN1CACNA1BAPBA1 | |
| Iodide SCHEMBL22345354 | 0.76 | BBOX1 (0.43) | KMT2AMEN1KDM4ETACR3SMN1; SMN2 | |
| SCHEMBL28641215 | 0.76 | KDM4E (0.52) | KMT2AL3MBTL1MEN1KDM4EUSP2 | |
| SCHEMBL22345590 | 0.75 | CCR1 (0.43) | KMT2AL3MBTL1MEN1PLK1KDM4E | |
| Sulfuric Acid SCHEMBL22345449 | 0.75 | KDM4E (0.49) | KMT2AL3MBTL1MEN1KDM4EUSP2 | |
| SCHEMBL22345593 | 0.75 | BBOX1 (0.44) | KMT2AMEN1KDM4ETACR3SMN1; SMN2 | |
| SCHEMBL22345591 | 0.75 | BBOX1 (0.44) | KMT2AMEN1KDM4ETACR3SMN1; SMN2 | |
| Iodide SCHEMBL22345583 | 0.74 | BBOX1 (0.43) | KMT2AMEN1KDM4ETACR3SMN1; SMN2 | |
| Iodide SCHEMBL22345356 | 0.74 | BBOX1 (0.43) | KMT2AMEN1KDM4ETACR3SMN1; SMN2 | |
| Iodide SCHEMBL28621490 | 0.72 | RORA (0.37) | L3MBTL1KDM4EPABPC1EIF4HSMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3924344-A1 | CINNOLINIUM COMPOUNDS FOR USE IN A METHOD OF CONTROLLING UNWANTED PLANT GROWTH | Syngenta Crop Protection AG (CH) | 2021-12-22 | — | — | EP | disclosed |
| CN-113423694-A | Cinnolinium compounds for use in a method for controlling unwanted plant growth | 先正达农作物保护股份公司 | 2021-09-21 | — | — | CN | disclosed |
| WO-2020164970-A1 | CINNOLINIUM COMPOUNDS FOR USE IN A METHOD OF CONTROLLING UNWANTED PLANT GROWTH | SYNGENTA CROP PROTECTION AG (CH) | 2020-08-20 | — | — | WO | disclosed |