Iodide

Iodide

SCHEMBL5088083

CCCCCCC[N+](CCCCCCC)(Cc1ccccc1)Cc1ccccc1.[I-]

nearest known ligand 0.68

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
ACHE known ✓ P22303 1/20 0.45
DNM1 Q05193 4/20 0.68
MEN1 O00255 2/20 0.66
KMT2A Q03164 2/20 0.66
TP53 P04637 2/20 0.66
SMN1; SMN2 Q16637 2/20 0.66
MAPK1 P28482 1/20 0.66
HTT P42858 2/20 0.64
SLC22A1 O15245 2/20 0.50
ALDH1A1 P00352 1/20 0.48
CYP3A4 P08684 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
ALOX12 P18054 1/20 0.48
HIF1A Q16665 1/20 0.48
HSD17B10 Q99714 1/20 0.48
SLC22A2 O15244 1/20 0.46
CYP1A2 P05177 1/20 0.45
PSMD14 O00487 1/20 0.45
HSP90AA1 P07900 1/20 0.45

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 SCHEMBL5087821 1.00 DNM1 (0.68) DNM1MEN1KMT2ATP53SMN1; SMN2
Iodide SCHEMBL5088560 1.00 DNM1 (0.68) DNM1MEN1KMT2ATP53SMN1; SMN2
Iodide SCHEMBL5087909 1.00 DNM1 (0.68) DNM1MEN1KMT2ATP53SMN1; SMN2
Iodide SCHEMBL5086727 1.00 DNM1 (0.68) DNM1MEN1KMT2ATP53SMN1; SMN2
Iodide SCHEMBL5087624 1.00 DNM1 (0.68) DNM1MEN1KMT2ATP53SMN1; SMN2
Iodide SCHEMBL5091697 1.00 DNM1 (0.68) DNM1MEN1KMT2ATP53SMN1; SMN2
Iodide SCHEMBL5092883 0.98 DNM1 (0.65) DNM1MEN1KMT2ATP53SMN1; SMN2
SCHEMBL16594023 0.98 DNM1 (0.70) DNM1MEN1KMT2ATP53SMN1; SMN2
SCHEMBL16594358 0.98 DNM1 (0.70) DNM1MEN1KMT2ATP53SMN1; SMN2
SCHEMBL333315 0.98 DNM1 (0.70) DNM1MEN1KMT2ATP53SMN1; SMN2

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-20080214386-A1 Stability; easily separated from solution; surface treatment of catalyst with Group seven compound; reacting epoxide with carbon dioxide NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2008-09-04 US disclosed