Sugi Predict

Sugi Predict / Compounds / Iodide

Iodide

Iodide

SCHEMBL9306486

CCCCCCCCCCCCCCCCOc1ccc(CN(Cc2cc[n+](C)cc2)C(=O)c2ccccc2)c(C)c1.[I-]

nearest known ligand 0.59

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 4)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.44
▸ TP53 P04637 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ PLA2G4B P0C869 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.

Compoundsimilaritytop predictedshared targets
Iodide SCHEMBL9307841 0.92 POLB (0.43) POLBTP53MAPTPLA2G4B
Iodide SCHEMBL9306058 0.91 POLB (0.42) POLBTP53PLA2G4B
Iodide SCHEMBL9306953 0.88 MAPT (0.43) TP53MAPT
Iodide SCHEMBL9307763 0.88 THRA (0.43) —
Iodide SCHEMBL9306747 0.88 MAPT (0.41) MAPT
Iodide SCHEMBL9305981 0.87 — —
Iodide SCHEMBL9307609 0.85 POLB (0.41) POLBTP53PLA2G4B
Iodide SCHEMBL9306544 0.85 TP53 (0.41) TP53PLA2G4B
Iodide SCHEMBL9307222 0.84 — —
Iodide SCHEMBL9306487 0.84 POLB (0.41) POLBPLA2G4B

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