Iodide

Iodide

SCHEMBL9307788

CCCCCCCCCCCCCCOc1cccc(CN(C(=O)c2ccc[n+](CCC)c2)c2ccccc2)c1C.[I-]

nearest known ligand 0.45

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 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.45
HSP90AA1 P07900 2/20 0.45
RAD52 P43351 2/20 0.45
APAF1 O14727 2/20 0.45
ALDH1A1 P00352 2/20 0.45
BLM P54132 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
USP2 O75604 1/20 0.45
XBP1 P17861 1/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
POLB P06746 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MEN1 O00255 1/20 0.35
NR1I2 O75469 1/20 0.35
CHRM2 P08172 1/20 0.35
CYP3A4 P08684 1/20 0.35
ADRA2A P08913 1/20 0.35

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 SCHEMBL9306288 0.85 MEN1 (0.38) LMNAALDH1A1MAPTMEN1NR1I2
Iodide SCHEMBL9307420 0.84 MEN1 (0.38) LMNAMAPTMEN1NR1I2CHRM2
Iodide SCHEMBL9308401 0.84 LMNA (0.45) LMNAHSP90AA1RAD52APAF1ALDH1A1
Iodide SCHEMBL9308416 0.83 LMNA (0.44) LMNAHSP90AA1RAD52APAF1ALDH1A1
Iodide SCHEMBL9307049 0.83 LMNA (0.44) LMNAHSP90AA1RAD52APAF1ALDH1A1
Iodide SCHEMBL9307654 0.83 LMNA (0.44) LMNAHSP90AA1RAD52APAF1ALDH1A1
Iodide SCHEMBL9308201 0.82 MEN1 (0.36) LMNAMAPTMEN1NR1I2CHRM2
Iodide SCHEMBL9307773 0.82 LMNA (0.47) LMNAHSP90AA1RAD52APAF1ALDH1A1
Iodide SCHEMBL9305571 0.81 LMNA (0.43) LMNAHSP90AA1RAD52APAF1ALDH1A1
Iodide SCHEMBL9306166 0.81 LMNA (0.43) LMNAHSP90AA1RAD52APAF1ALDH1A1

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