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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 8/20 | 0.46 |
| ▸ | PLEC | Q15149 | 1/20 | 0.40 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.39 |
| ▸ | TAS2R14 | Q9NYV8 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
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 SCHEMBL9305538 | 0.92 | CNR2 (0.45) | CNR2PLECMMP3CA12CA1 | |
| Iodide SCHEMBL9307766 | 0.88 | PDIA6 (0.39) | — | |
| Iodide SCHEMBL9307636 | 0.86 | CNR2 (0.46) | CNR2PLECMMP3CA12CA1 | |
| Iodide SCHEMBL9307608 | 0.86 | CNR2 (0.46) | CNR2PLECMMP3CA12CA1 | |
| Iodide SCHEMBL9307260 | 0.85 | CNR2 (0.42) | CNR2 | |
| Iodide SCHEMBL9306710 | 0.82 | CNR2 (0.41) | CNR2PLECMMP3 | |
| Iodide SCHEMBL9306218 | 0.82 | CNR2 (0.41) | CNR2PLECMMP3 | |
| Iodide SCHEMBL9306534 | 0.80 | ALDH1A1 (0.47) | CNR2TAS2R14 | |
| Iodide SCHEMBL9305875 | 0.80 | CNR2 (0.50) | CNR2MAPTCNR1 | |
| Iodide SCHEMBL9307593 | 0.79 | THRA (0.39) | — |
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-5328921-A | Antagonist of platelet activating factor | AMERICAN CYANAMID COMPANY (US) | 1994-07-12 | — | — | US | disclosed |