Iodide

Iodide

SCHEMBL8513379

CCC[n+]1ccn(C)c1I.[I-]

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

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 7)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.47
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
POLB P06746 1/20 0.33
APOBEC3A P31941 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL16783875 0.81
Iodide SCHEMBL180207 0.79 CA1 (0.41) HDAC8CA1CA2POLBAPOBEC3A
SCHEMBL319283 0.77 CA1 (0.42) HDAC8CA1CA2POLBAPOBEC3A
Water SCHEMBL15365843 0.75 CA1 (0.41) HDAC8CA1CA2POLBAPOBEC3A
Hydrochloric Acid SCHEMBL1884665 0.75 CA1 (0.41) HDAC8CA1CA2POLBAPOBEC3A
Bromide SCHEMBL8204078 0.75 CA1 (0.45) HDAC8CA1CA2POLBAPOBEC3A
SCHEMBL30779767 0.75 CA1 (0.45) HDAC8CA1CA2POLBAPOBEC3A
Fluoride Ion SCHEMBL21980196 0.75 CA1 (0.41) HDAC8CA1CA2POLBAPOBEC3A
Iodide SCHEMBL5579282 0.74 CA1 (0.38) HDAC8CA1CA2
SCHEMBL427789 0.73 CA1 (0.33) HDAC8CA1CA2POLBAPOBEC3A

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9932316-B2 Imidazolium salts having liquid crystal characteristics, useful as electrolytes DAUNIA SOLAR CELL S.R.L. (IT) 2018-04-03 US disclosed
EP-2440532-B1 Imidazolium salts having liquid crystal characteristics, useful as electrolytes DAUNIA SOLAR CELL S R L (IT) 2015-08-05 EP disclosed
US-20120135316-A1 NEW IMIDAZOLIUM SALTS HAVING LIQUID CRYSTAL CHARACTERISTICS, USEFUL AS ELECTROLYTES DAUNIA SOLAR CELL S.R.L. (IT) 2012-05-31 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120135316-A1 NEW IMIDAZOLIUM SALTS HAVING LIQUID CRYSTAL CHARACTERISTICS, USEFUL AS ELECTROLYTES KCNH2, KCNH3, HCN2 HDAC8 4224/4885CA1 193/4885CA2 48/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.