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 | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | MIF | P14174 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.33 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9752172 | 0.94 | HIF1A (0.43) | HIF1ALMNATP53ESR1TRPA1 | |
| Fluoride Ion SCHEMBL4618615 | 0.94 | HIF1A (0.43) | HIF1ALMNATP53ESR1TRPA1 | |
| Bromide SCHEMBL679805 | 0.94 | HIF1A (0.43) | HIF1ALMNATP53ESR1TRPA1 | |
| Hydrochloric Acid SCHEMBL2965186 | 0.94 | HIF1A (0.43) | HIF1ALMNATP53ESR1TRPA1 | |
| Water SCHEMBL2822588 | 0.94 | HIF1A (0.43) | HIF1ALMNATP53ESR1TRPA1 | |
| SCHEMBL8206187 | 0.84 | LMNA (0.39) | HIF1ALMNAMEN1KMT2AALDH1A1 | |
| SCHEMBL9752213 | 0.84 | HIF1A (0.36) | HIF1ALMNATP53ESR1TSHR | |
| Oxalic Acid SCHEMBL1049238 | 0.82 | CES2 (0.41) | LMNATSHRMEN1KMT2AALDH1A1 | |
| Hydrochloric Acid SCHEMBL11011118 | 0.82 | APOBEC3A (0.35) | HIF1ALMNAMIFCYP2D6 | |
| Hydrochloric Acid SCHEMBL5180858 | 0.80 | HIF1A (0.42) | HIF1ALMNATP53ESR1TRPA1 |
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-20080214386-A1 | Stability; easily separated from solution; surface treatment of catalyst with Group seven compound; reacting epoxide with carbon dioxide | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2008-09-04 | — | — | US | disclosed |