Iodide

Iodide

SCHEMBL9307428

CCCCCCCCCCCCCCCCOc1ccc(CN(Cc2cc[n+](C)cc2)C(=O)c2ccccc2OC)cc1Cl.[I-]

nearest known ligand 0.51

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 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
TP53 P04637 2/20 0.41
ATM Q13315 1/20 0.41
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
LPAR1 Q92633 1/20 0.41
NR1H4 Q96RI1 1/20 0.41
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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 SCHEMBL9306347 0.92 LMNA (0.44) MAPTTHRATHRBLPAR1LMNA
Iodide SCHEMBL9308303 0.91 ATM (0.40) ATMLPAR1NR1H4
Iodide SCHEMBL9307453 0.90 RAF1 (0.50) MAPTTP53NR1H4
Iodide SCHEMBL9306206 0.89
Iodide SCHEMBL9307799 0.88 THRA (0.45) ATMTHRATHRB
Iodide SCHEMBL9306025 0.88 THRA (0.42) THRATHRB
Iodide SCHEMBL9308385 0.87 ATM (0.42) MAPTATMLMNA
Iodide SCHEMBL9308352 0.86 LMNA (0.40) MAPTATMTHRATHRBLPAR1
Iodide SCHEMBL9306128 0.86 LMNA (0.40) MAPTATMTHRATHRBLPAR1
Iodide SCHEMBL9306807 0.86 ATM (0.38) ATM

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