Iodide

Iodide

SCHEMBL9308213

CCCCCCCCCCCCOc1ccc(CN(C(=O)c2cccc[n+]2CC)c2ccccc2)c(C)c1.[I-]

nearest known ligand 0.47

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
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
PTPN11 Q06124 1/20 0.39
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
FAAH O00519 6/20 0.37
PLA2G4B P0C869 1/20 0.37

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 SCHEMBL9306316 1.00 THRA (0.40) THRATHRBPTPN11LMNATP53
Iodide SCHEMBL9308214 0.94 THRA (0.39) THRATHRBPTPN11LMNATP53
Iodide SCHEMBL9308851 0.91 THRA (0.43) THRATHRBPTPN11
Iodide SCHEMBL9306783 0.91 THRA (0.43) THRATHRBPTPN11
Iodide SCHEMBL9307641 0.84 TP53 (0.41) THRATHRBPTPN11LMNATP53
Iodide SCHEMBL9306544 0.83 TP53 (0.41) THRATHRBPTPN11LMNATP53
Iodide SCHEMBL9309278 0.82 LMNA (0.41) THRATHRBPTPN11LMNATP53
Iodide SCHEMBL9306634 0.82 LMNA (0.41) THRATHRBPTPN11LMNATP53
Iodide SCHEMBL9307369 0.81 LMNA (0.41) THRATHRBPTPN11LMNATP53
Iodide SCHEMBL9307732 0.81 LMNA (0.41) THRATHRBPTPN11LMNATP53

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