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 | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.36 |
| ▸ | MAT2A | P31153 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | S1PR2 | O95136 | 2/20 | 0.34 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
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 | 0.91 | MAPT (0.41) | MAPTMEN1LMNAKMT2ATHRB | |
| Iodide SCHEMBL4455368 | 0.90 | MAPT (0.40) | MAPTMEN1LMNAKMT2ATHRB | |
| SCHEMBL7468729 | 0.88 | MAPT (0.46) | MAPTMEN1LMNAKMT2ATHRB | |
| Iodide SCHEMBL7467987 | 0.86 | RXFP1 (0.45) | MAPTLMNATHRBTP53SMN1; SMN2 | |
| SCHEMBL7457276 | 0.84 | MAPT (0.47) | MAPTMEN1LMNAKMT2ATHRB | |
| SCHEMBL7468043 | 0.83 | MAPT (0.48) | MAPTMEN1LMNAKMT2ATHRB | |
| SCHEMBL7460793 | 0.82 | MAPT (0.51) | MAPTMEN1LMNAKMT2ATHRB | |
| Iodide SCHEMBL7464178 | 0.81 | MAPT (0.37) | MAPTMEN1LMNAKMT2ATP53 | |
| Iodide SCHEMBL7462209 | 0.80 | MAPT (0.41) | MAPTMEN1LMNAKMT2ATHRB | |
| SCHEMBL7463809 | 0.80 | TP53 (0.51) | MAPTLMNATHRBCHRNB4CHRNA3 |
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 |