Iodide

Iodide

SCHEMBL9305875

CCCCCCCCCCCCCCOc1ccc(CN(Cc2cc[n+](C)cc2)S(=O)(=O)c2ccc(C)cc2)cc1Cl.[I-]

nearest known ligand 0.50

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
CNR2 P34972 11/20 0.50
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
GLA P06280 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CNR1 P21554 2/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
RECQL P46063 1/20 0.40
POLB P06746 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 SCHEMBL9307365 0.92 CNR2 (0.49) CNR2MAPTTHRBCNR1LMNA
Iodide SCHEMBL9307537 0.92 CNR2 (0.49) CNR2MAPTTHRBCNR1LMNA
Iodide SCHEMBL9305091 0.91 CNR2 (0.48) CNR2MAPTTHRBCNR1TSHR
Iodide SCHEMBL9306534 0.89 ALDH1A1 (0.47) CNR2SMN1; SMN2LMNATSHRHTT
Iodide SCHEMBL9307061 0.87 CNR2 (0.45) CNR2THRBCNR1LMNATSHR
Iodide SCHEMBL9306786 0.87 CNR2 (0.46) CNR2MAPTTHRB
Iodide SCHEMBL9307893 0.86 CNR2 (0.46) CNR2MAPTTHRBCNR1LMNA
Iodide SCHEMBL9306770 0.84 CNR2 (0.45) CNR2MAPTTHRBCNR1TSHR
Iodide SCHEMBL9307171 0.81 ALDH1A1 (0.47) CNR2MAPTSMN1; SMN2LMNATSHR
Iodide SCHEMBL9306262 0.80 TAS2R14 (0.48) CNR2SMN1; SMN2CNR1LMNATSHR

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