Iodide

Iodide

SCHEMBL9307705

CCCCCCCCCCCCOc1ccc(OCC(=O)NCCc2cc[n+](C)cc2)c(OC)c1.[I-]

nearest known ligand 0.51

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
ALDH1A1 P00352 2/20 0.48
MAPT P10636 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
PLA2G4B P0C869 1/20 0.48
LMNA P02545 2/20 0.47
PKM P14618 1/20 0.47
POLB P06746 1/20 0.46
APOBEC3A P31941 1/20 0.46
APOBEC3G Q9HC16 1/20 0.46
CNR2 P34972 1/20 0.46
KMT2A Q03164 1/20 0.46

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 SCHEMBL9307293 1.00 ALDH1A1 (0.48) ALDH1A1MAPTSMN1; SMN2PLA2G4BLMNA
Iodide SCHEMBL9307358 0.96 SMN1; SMN2 (0.49) ALDH1A1MAPTSMN1; SMN2PLA2G4BLMNA
Iodide SCHEMBL9306592 0.96 SMN1; SMN2 (0.49) ALDH1A1MAPTSMN1; SMN2PLA2G4BLMNA
Iodide SCHEMBL9305993 0.93 ALDH1A1 (0.48) ALDH1A1MAPTSMN1; SMN2PLA2G4BLMNA
Iodide SCHEMBL9306556 0.93 ALDH1A1 (0.48) ALDH1A1MAPTSMN1; SMN2PLA2G4BLMNA
Iodide SCHEMBL9308398 0.92 ALDH1A1 (0.48) ALDH1A1MAPTSMN1; SMN2PLA2G4BLMNA
Iodide SCHEMBL9307937 0.90 SMN1; SMN2 (0.47) ALDH1A1MAPTSMN1; SMN2PLA2G4BLMNA
Iodide SCHEMBL9307735 0.90 SMN1; SMN2 (0.47) ALDH1A1MAPTSMN1; SMN2PLA2G4BLMNA
Iodide SCHEMBL9305961 0.89 SMN1; SMN2 (0.49) ALDH1A1MAPTSMN1; SMN2PLA2G4BLMNA
Iodide SCHEMBL9309055 0.89 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2LMNACNR2

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