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 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 20/20 | 1.00 |
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 SCHEMBL3993066 | 0.89 | ADORA1 (1.00) | ADORA1 | |
| Iodide SCHEMBL3994593 | 0.86 | ADORA1 (1.00) | ADORA1 | |
| Iodide SCHEMBL3990143 | 0.84 | ADORA1 (0.78) | ADORA1 | |
| Iodide SCHEMBL3992771 | 0.83 | ADORA1 (1.00) | ADORA1 | |
| Iodide SCHEMBL3994608 | 0.82 | ADORA1 (0.74) | ADORA1 | |
| SCHEMBL13943065 | 0.82 | ADORA1 (0.69) | ADORA1 | |
| Iodide SCHEMBL3994554 | 0.81 | ADORA1 (1.00) | ADORA1 | |
| Iodide SCHEMBL3988839 | 0.81 | ADORA1 (1.00) | ADORA1 | |
| SCHEMBL13943075 | 0.80 | ADORA1 (0.98) | ADORA1 | |
| Iodide SCHEMBL4618850 | 0.77 | ADORA1 (1.00) | ADORA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1583530-A4 | 2-AMINOTHIAZOLE ALLOSTERIC ENHANCERS OF A1-ADENOSINE RECEPTORS | UNIV VIRGINIA (US) | 2008-07-23 | — | — | EP | disclosed |
| EP-1583530-A1 | 2-AMINOTHIAZOLE ALLOSTERIC ENHANCERS OF A1-ADENOSINE RECEPTORS | UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) | 2005-10-12 | — | — | EP | disclosed |
| WO-2003061655-A1 | 2-AMINOTHIAZOLE ALLOSTERIC ENHANCERS OF A1 ADENOSINE RECEPTORS | UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) | 2003-07-31 | — | — | WO | disclosed |