Iodide

Iodide

SCHEMBL9308210

CCCCCCCCCCCCCCOc1cccc(C(CC)NC(=O)c2cc[n+](CCC)cc2)c1C.[I-]

nearest known ligand 0.41

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
PPARG P37231 5/20 0.39
PPARA Q07869 1/20 0.39
CYSLTR2 Q9NS75 2/20 0.38
CYSLTR1 Q9Y271 2/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
NR1I2 O75469 1/20 0.37
LMNA P02545 1/20 0.37
CHRM2 P08172 1/20 0.37
CYP3A4 P08684 1/20 0.37
ADRA2A P08913 1/20 0.37
MAPT P10636 1/20 0.37
OPRK1 P41145 1/20 0.37
HTR2B P41595 1/20 0.37
SLC6A3 Q01959 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
SMPD1 P17405 4/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
APAF1 O14727 1/20 0.36

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 SCHEMBL9306472 0.82 HPGD (0.43) PPARGPPARAMAPTSMPD1SMN1; SMN2
Iodide SCHEMBL9307988 0.80 PPARG (0.45) PPARGPPARASMPD1
Iodide SCHEMBL9307315 0.80 SMPD1 (0.47) KMT2ALMNAMAPTSMPD1SMN1; SMN2
Iodide SCHEMBL9307547 0.80 SMPD1 (0.47) KMT2ALMNAMAPTSMPD1SMN1; SMN2
Iodide SCHEMBL9308100 0.80 PPARG (0.45) PPARGPPARASMPD1
Iodide SCHEMBL9307588 0.78 THRA (0.43) PPARGPPARASMPD1SMN1; SMN2NPSR1
Iodide SCHEMBL9307774 0.78 THRA (0.43) PPARGPPARASMPD1SMN1; SMN2NPSR1
Iodide SCHEMBL9306740 0.78 HPGD (0.43) PPARGPPARAMAPTSMPD1SMN1; SMN2
Iodide SCHEMBL9309375 0.76 THRA (0.45) PPARGPPARAMEN1KMT2AMAPT
Iodide SCHEMBL9307639 0.76 THRA (0.45) PPARGPPARAMEN1KMT2AMAPT

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