Iodide

Iodide

SCHEMBL9306858

CCCCCCCCCCCCCCCCOc1ccc(OCC(=O)NCc2cccc[n+]2CC)cc1.[I-]

nearest known ligand 0.59

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 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.49
RECQL P46063 1/20 0.49
KDM4E B2RXH2 1/20 0.46
PLA2G4B P0C869 4/20 0.44
PLA2G4A P47712 1/20 0.44
FAAH O00519 2/20 0.43
LMNA P02545 1/20 0.43

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 SCHEMBL9305539 0.89 TSHR (0.53) TSHRRECQLKDM4E
Iodide SCHEMBL9306410 0.87 HPGD (0.55) LMNA
Iodide SCHEMBL9307741 0.83 PTPN11 (0.41) KDM4E
Iodide SCHEMBL9307202 0.83 PTPN11 (0.41) KDM4E
Iodide SCHEMBL9306589 0.82 CNR1 (0.48)
Iodide SCHEMBL9308269 0.80 THRB (0.48)
Iodide SCHEMBL9305570 0.80 THRB (0.48)
Iodide SCHEMBL9306102 0.79 THRA (0.48)
Iodide SCHEMBL9306253 0.79 THRA (0.48)
Iodide SCHEMBL9307113 0.78 TSHR (0.43) TSHRRECQLKDM4ELMNA

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 3 patents. 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
US-5208247-A Antianaphylactic agents or septic shock AMERICAN CYANAMID COMPANY (US) 1993-05-04 US disclosed
EP-0530444-A1 Aryl, amide, imide, and carbamate pyridine antagonists of platelet activating factor AMERICAN CYANAMID COMPANY (US) 1993-03-10 EP disclosed