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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR2 | O95136 | 1/20 | 0.52 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.52 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.52 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.52 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | THRA | P10827 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
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 SCHEMBL9308241 | 1.00 | S1PR2 (0.52) | S1PR2S1PR1S1PR3LPAR2CNR2 | |
| Iodide SCHEMBL9305242 | 1.00 | S1PR2 (0.52) | S1PR2S1PR1S1PR3LPAR2CNR2 | |
| Iodide SCHEMBL9307378 | 0.90 | S1PR2 (0.52) | S1PR2S1PR1S1PR3LPAR2MEN1 | |
| Iodide SCHEMBL9306451 | 0.89 | S1PR2 (0.52) | S1PR2S1PR1S1PR3LPAR2CNR2 | |
| Iodide SCHEMBL9306103 | 0.89 | POLB (0.51) | S1PR2S1PR1S1PR3LPAR2CNR2 | |
| Iodide SCHEMBL9306805 | 0.89 | POLB (0.51) | S1PR2S1PR1S1PR3LPAR2CNR2 | |
| Iodide SCHEMBL9307141 | 0.87 | THRA (0.45) | CNR2THRATHRBHDAC3 | |
| Iodide SCHEMBL9306452 | 0.87 | THRA (0.45) | CNR2THRATHRBHDAC3 | |
| Iodide SCHEMBL9307184 | 0.85 | S1PR2 (0.46) | S1PR2S1PR1S1PR3LPAR2CNR2 | |
| Iodide SCHEMBL9307883 | 0.85 | S1PR2 (0.46) | S1PR2S1PR1S1PR3LPAR2CNR2 |
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 |