Iodide

Iodide

SCHEMBL9733834

COc1ccc(OS(=O)(=O)c2ccc(C)cc2)cc1.I

nearest known ligand 0.58

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 2/20 0.56
HTT P42858 2/20 0.58
LMNA P02545 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
GAA P10253 1/20 0.56
CA2 P00918 4/20 0.54
CA12 O43570 2/20 0.54
PKM P14618 1/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
ALDH1A1 P00352 3/20 0.51
BCHE P06276 1/20 0.51
MAOB P27338 1/20 0.51
CA1 P00915 2/20 0.50
CA9 Q16790 2/20 0.50
MAPT P10636 1/20 0.50
TUBB4A P04350 1/20 0.50
TUBB P07437 1/20 0.50

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
SCHEMBL6938753 0.98 HTT (0.60) HTTLMNASMN1; SMN2TDP1L3MBTL1
SCHEMBL10413156 0.98 HTT (0.60) HTTLMNASMN1; SMN2TDP1L3MBTL1
SCHEMBL19014762 0.93 CA12 (0.58) HTTLMNASMN1; SMN2TDP1L3MBTL1
Iodide SCHEMBL22068772 0.92 CA2 (0.59) HTTLMNASMN1; SMN2TDP1L3MBTL1
SCHEMBL8818892 0.90 TDP1 (0.68) HTTLMNASMN1; SMN2TDP1L3MBTL1
SCHEMBL4126086 0.90 MEN1 (0.60) HTTLMNASMN1; SMN2TDP1L3MBTL1
SCHEMBL18179825 0.90 MEN1 (0.60) HTTLMNASMN1; SMN2TDP1L3MBTL1
SCHEMBL9852204 0.90 MEN1 (0.60) HTTLMNASMN1; SMN2TDP1L3MBTL1
SCHEMBL28853028 0.89 ACHE (0.56) HTTLMNASMN1; SMN2TDP1L3MBTL1
SCHEMBL19014763 0.87 HTT (0.50) HTTLMNASMN1; SMN2TDP1L3MBTL1

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-5086192-A Photopolymerizable compositions and photoinitiators therefor MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-02-04 US disclosed