Iodide

Iodide

SCHEMBL9306953

CCCCCCCCCCCCCCCCOc1ccc(CN(Cc2cc[n+](C)cc2)C(=O)c2ccccc2Cl)c(C)c1.[I-]

nearest known ligand 0.55

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 5)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
TP53 P04637 1/20 0.43
THRA P10827 2/20 0.41
THRB P10828 2/20 0.41
PTPN11 Q06124 1/20 0.40

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 SCHEMBL9306065 0.92 TP53 (0.40) MAPTTP53THRATHRBPTPN11
Iodide SCHEMBL9306747 0.89 MAPT (0.41) MAPTTHRATHRB
Iodide SCHEMBL9306486 0.88 POLB (0.44) MAPTTP53
Iodide SCHEMBL9308774 0.87 TP53 (0.39) MAPTTP53THRATHRBPTPN11
Iodide SCHEMBL9306528 0.86 TP53 (0.38) MAPTTP53THRATHRBPTPN11
Iodide SCHEMBL9307763 0.84 THRA (0.43) THRATHRB
Iodide SCHEMBL9306256 0.84 TP53 (0.46) MAPTTP53
Iodide SCHEMBL9305994 0.81 THRA (0.40) MAPTTHRATHRBPTPN11
Iodide SCHEMBL9309467 0.81 THRA (0.39) THRATHRB
Iodide SCHEMBL9307841 0.80 POLB (0.43) MAPTTP53THRATHRBPTPN11

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