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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.56 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.52 |
| ▸ | KDM1A | O60341 | 2/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.52 |
| ▸ | IP6K2 | Q9UHH9 | 2/20 | 0.52 |
| ▸ | XDH | P47989 | 1/20 | 0.52 |
| ▸ | IPMK | Q8NFU5 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | PLG | P00747 | 1/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.50 |
| ▸ | PDE4A | P27815 | 1/20 | 0.49 |
| ▸ | FLT3 | P36888 | 1/20 | 0.48 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7306671 | 0.99 | CYP1B1 (0.57) | CYP1B1CYP1A1CYP1A2ABCC1KDM1A | |
| SCHEMBL7305779 | 0.89 | CYP1B1 (0.56) | CYP1B1CYP1A1CYP1A2ABCC1KDM1A | |
| SCHEMBL7313359 | 0.88 | CYP1B1 (0.55) | CYP1B1CYP1A1CYP1A2ABCC1KDM1A | |
| SCHEMBL7303645 | 0.87 | CYP1B1 (0.57) | CYP1B1CYP1A1CYP1A2ABCC1KDM1A | |
| SCHEMBL7311118 | 0.87 | CYP1B1 (0.57) | CYP1B1CYP1A1CYP1A2ABCC1KDM1A | |
| SCHEMBL7316873 | 0.87 | CYP1B1 (0.57) | CYP1B1CYP1A1CYP1A2ABCC1KDM1A | |
| SCHEMBL7306024 | 0.86 | CYP1B1 (0.76) | CYP1B1CYP1A1CYP1A2ABCC1KDM1A | |
| SCHEMBL7306096 | 0.86 | CYP1B1 (0.56) | CYP1B1CYP1A1CYP1A2ABCC1KDM1A | |
| SCHEMBL7315053 | 0.86 | MAPT (0.62) | CYP1B1CYP1A1CYP1A2ABCC1KDM1A | |
| SCHEMBL7309980 | 0.86 | CYP1B1 (0.52) | CYP1B1CYP1A1CYP1A2ABCC1KDM1A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5889003-A | PHOSPHODIESTERASE INHIBITOR | ADIR ET COMPAGNIE (FR) | 1999-03-30 | — | — | US | disclosed |