Iodide

Iodide

SCHEMBL9306347

CCCCCCCCCCCCCCOc1ccc(CN(Cc2cc[n+](C)cc2)C(=O)c2ccccc2OC)cc1OC.[I-]

nearest known ligand 0.53

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 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LPAR1 Q92633 1/20 0.42
THRA P10827 1/20 0.42
THRB P10828 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 SCHEMBL9307428 0.92 MAPT (0.41) LMNAMAPTHTTSMN1; SMN2L3MBTL1
Iodide SCHEMBL9307453 0.92 RAF1 (0.50) MAPT
Iodide SCHEMBL9305821 0.92 MAPT (0.44) LMNAMAPTHTTSMN1; SMN2L3MBTL1
Iodide SCHEMBL9307162 0.91 THRA (0.45) THRATHRB
Iodide SCHEMBL9306025 0.90 THRA (0.42) THRATHRB
Iodide SCHEMBL9305092 0.88
Iodide SCHEMBL9306943 0.87 LMNA (0.43) LMNAMAPTHTTSMN1; SMN2L3MBTL1
Iodide SCHEMBL9307761 0.86 THRA (0.46) THRATHRB
Iodide SCHEMBL9306525 0.86 LMNA (0.41) LMNAMAPTHTTSMN1; SMN2L3MBTL1
Iodide SCHEMBL9308427 0.86 LMNA (0.42) LMNAMAPTHTTSMN1; SMN2L3MBTL1

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