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 | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 14/20 | 0.37 |
| ▸ | TP53 | P04637 | 7/20 | 0.35 |
| ▸ | LMNA | P02545 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL7469549 | 0.85 | MAPT (0.41) | MAPTTP53LMNASMN1; SMN2MEN1 | |
| SCHEMBL7472637 | 0.85 | MEN1 (0.40) | MAPTLMNASMN1; SMN2MEN1KMT2A | |
| Iodide SCHEMBL4455368 | 0.84 | MAPT (0.40) | MAPTTP53LMNASMN1; SMN2MEN1 | |
| SCHEMBL7467945 | 0.82 | AKR1B1 (0.39) | MAPTSMN1; SMN2GAA | |
| Iodide SCHEMBL7467987 | 0.82 | RXFP1 (0.45) | MAPTTP53LMNASMN1; SMN2ALDH1A1 | |
| Iodide SCHEMBL7466550 | 0.81 | MAPT (0.38) | MAPTTP53LMNASMN1; SMN2MEN1 | |
| Iodide SCHEMBL7464172 | 0.81 | GAA (0.35) | GAAKDM4EALDH1A1 | |
| SCHEMBL7467191 | 0.80 | L3MBTL1 (0.45) | MAPTTP53LMNASMN1; SMN2MEN1 | |
| SCHEMBL7460868 | 0.80 | GAA (0.36) | MAPTSMN1; SMN2GAA | |
| SCHEMBL8705102 | 0.76 | GAA (0.38) | MAPTLMNASMN1; SMN2MEN1KMT2A |
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 |