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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR2 | O95136 | 1/20 | 0.49 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.49 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.49 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 SCHEMBL9307109 | 1.00 | S1PR2 (0.49) | S1PR2S1PR1S1PR3LPAR2CA1 | |
| Iodide SCHEMBL9305749 | 0.91 | S1PR2 (0.48) | S1PR2S1PR1S1PR3LPAR2CA1 | |
| Iodide SCHEMBL9308500 | 0.91 | S1PR2 (0.48) | S1PR2S1PR1S1PR3LPAR2CA1 | |
| Iodide SCHEMBL9307396 | 0.91 | S1PR2 (0.48) | S1PR2S1PR1S1PR3LPAR2CA1 | |
| Iodide SCHEMBL9308103 | 0.91 | S1PR2 (0.48) | S1PR2S1PR1S1PR3LPAR2CA1 | |
| Iodide SCHEMBL9307010 | 0.88 | HSD17B10 (0.58) | S1PR2S1PR1S1PR3LPAR2NPSR1 | |
| Iodide SCHEMBL9307860 | 0.88 | HSD17B10 (0.58) | S1PR2S1PR1S1PR3LPAR2NPSR1 | |
| Iodide SCHEMBL9309300 | 0.86 | THRA (0.45) | NPSR1 | |
| Iodide SCHEMBL9306366 | 0.86 | THRA (0.45) | NPSR1 | |
| Iodide SCHEMBL9307333 | 0.84 | POLB (0.52) | S1PR2S1PR1S1PR3LPAR2 |
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 |