Sugi Predict

Sugi Predict / Compounds / Iodide

Iodide

Iodide

SCHEMBL9308048

CCCCCCCCCCCCCCOc1ccc(C(=O)NCc2cccc[n+]2C)c(Cl)c1.[I-]

nearest known ligand 0.54

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 3)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 5/20 0.48
▸ THRA P10827 1/20 0.48
▸ ALDH1A1 P00352 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 SCHEMBL9306131 1.00 THRB (0.48) THRBTHRAALDH1A1
Iodide SCHEMBL9308269 0.89 THRB (0.48) THRBTHRAALDH1A1
Iodide SCHEMBL9305570 0.89 THRB (0.48) THRBTHRAALDH1A1
Iodide SCHEMBL9308082 0.89 THRB (0.47) THRBTHRAALDH1A1
Iodide SCHEMBL9307338 0.89 THRB (0.47) THRBTHRAALDH1A1
Iodide SCHEMBL9305291 0.87 THRA (0.49) THRBTHRAALDH1A1
Iodide SCHEMBL9306773 0.83 HPGD (0.56) —
Iodide SCHEMBL9307719 0.83 THRB (0.51) THRBTHRAALDH1A1
Iodide SCHEMBL9307652 0.83 THRB (0.51) THRBTHRAALDH1A1
Iodide SCHEMBL9307767 0.82 THRB (0.48) THRBTHRAALDH1A1

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