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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXFP1 | Q9HBX9 | 9/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 8/20 | 0.42 |
| ▸ | S1PR2 | O95136 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 6/20 | 0.41 |
| ▸ | POLB | P06746 | 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 SCHEMBL4455368 | 0.94 | MAPT (0.40) | RXFP1LMNAMAPTS1PR2ALDH1A1 | |
| Iodide SCHEMBL7469549 | 0.91 | MAPT (0.41) | RXFP1LMNAMAPTS1PR2ALDH1A1 | |
| Iodide SCHEMBL7466550 | 0.86 | MAPT (0.38) | LMNAMAPTS1PR2SMN1; SMN2THRB | |
| Iodide SCHEMBL7462209 | 0.84 | MAPT (0.41) | RXFP1LMNAMAPTS1PR2ALDH1A1 | |
| SCHEMBL7463809 | 0.84 | TP53 (0.51) | RXFP1LMNAMAPK1MAPTS1PR2 | |
| Bromide SCHEMBL7469463 | 0.83 | MAPT (0.39) | RXFP1LMNAMAPTS1PR2ALDH1A1 | |
| Iodide SCHEMBL7464178 | 0.82 | MAPT (0.37) | RXFP1LMNAMAPTS1PR2ALDH1A1 | |
| SCHEMBL7563746 | 0.80 | MAPT (0.49) | RXFP1LMNAMAPTS1PR2ALDH1A1 | |
| Iodide SCHEMBL7468583 | 0.80 | MAPT (0.43) | LMNAMAPTS1PR2ALDH1A1SMN1; SMN2 | |
| SCHEMBL7472814 | 0.79 | PPARG (0.51) | RXFP1 |
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-0795548-B1 | QUINAZOLINE DERIVATIVES AND USE THEREOF | SUNTORY LTD (JP) | 2002-07-03 | — | — | EP | disclosed |
| EP-0795548-A1 | QUINAZOLINE DERIVATIVES AND USE THEREOF | SUNTORY LIMITED (JP) | 1997-09-17 | — | — | EP | disclosed |