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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 7/20 | 0.46 |
| ▸ | TAS2R14 | Q9NYV8 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | 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 | 0.80 | CNR2 (0.45) | CNR2TAS2R14HTTMAPTPKM | |
| Iodide SCHEMBL9305550 | 0.79 | BCHE (0.43) | BCHE | |
| Iodide SCHEMBL9307171 | 0.79 | ALDH1A1 (0.47) | CNR2TAS2R14ALDH1A1LMNAHTT | |
| Iodide SCHEMBL9307537 | 0.78 | CNR2 (0.49) | CNR2ALDH1A1LMNAKDM4EHTT | |
| Iodide SCHEMBL9305907 | 0.77 | BCHE (0.46) | ALDH1A1KDM4ESMN1; SMN2BCHE | |
| Iodide SCHEMBL9306187 | 0.77 | CNR2 (0.45) | CNR2TAS2R14HTTCNR1 | |
| Iodide SCHEMBL9307816 | 0.76 | CNR2 (0.46) | CNR2TAS2R14LMNAHTTCNR1 | |
| Iodide SCHEMBL9306534 | 0.75 | ALDH1A1 (0.47) | CNR2TAS2R14ALDH1A1LMNAHTT | |
| Iodide SCHEMBL9307657 | 0.75 | BCHE (0.43) | ALDH1A1BCHE | |
| Iodide SCHEMBL9307068 | 0.75 | TAS2R14 (0.39) | CNR2TAS2R14ALDH1A1TP53 |
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 |