Iodide

Iodide

SCHEMBL9306867

CCCCCCCCCCCCOc1ccc(C(=O)NCc2cc[n+](CC)cc2)c(Cl)c1.[I-]

nearest known ligand 0.55

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 6)

geneUniProtsupporting neighboursconfidence
THRB P10828 6/20 0.51
THRA P10827 1/20 0.51
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 1/20 0.43
FAAH O00519 1/20 0.43

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
Iodide SCHEMBL9305547 1.00 THRB (0.51) THRBTHRALMNASMN1; SMN2ALDH1A1
Iodide SCHEMBL9307224 0.94 THRB (0.51) THRBTHRALMNASMN1; SMN2ALDH1A1
Iodide SCHEMBL9307652 0.92 THRB (0.51) THRBTHRALMNASMN1; SMN2ALDH1A1
Iodide SCHEMBL9307719 0.92 THRB (0.51) THRBTHRALMNASMN1; SMN2ALDH1A1
Iodide SCHEMBL9306812 0.88 THRB (0.48) THRBTHRASMN1; SMN2ALDH1A1FAAH
Iodide SCHEMBL9307238 0.88 THRB (0.48) THRBTHRASMN1; SMN2ALDH1A1FAAH
Iodide SCHEMBL9309113 0.87 THRA (0.52) THRBTHRALMNASMN1; SMN2ALDH1A1
Iodide SCHEMBL9307976 0.87 THRA (0.52) THRBTHRALMNASMN1; SMN2ALDH1A1
Iodide SCHEMBL9306330 0.86 THRB (0.42) THRBTHRALMNASMN1; SMN2ALDH1A1
Iodide SCHEMBL9306085 0.86 THRB (0.42) THRBTHRALMNASMN1; SMN2ALDH1A1

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5328921-A Antagonist of platelet activating factor AMERICAN CYANAMID COMPANY (US) 1994-07-12 US disclosed