Iodide

Iodide

SCHEMBL9307470

CCCCCCCCCCCCOc1ccc(CC(=O)NCc2cccc[n+]2CCC)cc1C(C)(C)C.[I-]

nearest known ligand 0.48

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 4)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.42
HSD17B10 Q99714 1/20 0.42
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41

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 SCHEMBL9309074 1.00 NPSR1 (0.42) NPSR1HSD17B10THRATHRB
Iodide SCHEMBL9307051 0.94 NPSR1 (0.42) NPSR1HSD17B10THRATHRB
Iodide SCHEMBL9307760 0.94 NPSR1 (0.42) NPSR1HSD17B10THRATHRB
Iodide SCHEMBL9307376 0.88 HSD17B10 (0.55) NPSR1HSD17B10
Iodide SCHEMBL9309198 0.88 S1PR2 (0.45) NPSR1HSD17B10THRATHRB
Iodide SCHEMBL9307084 0.88 S1PR2 (0.45) NPSR1HSD17B10THRATHRB
Iodide SCHEMBL9305956 0.88 HSD17B10 (0.55) NPSR1HSD17B10
Iodide SCHEMBL9307302 0.85 THRA (0.49) THRATHRB
Iodide SCHEMBL9306857 0.85 THRA (0.49) THRATHRB
Iodide SCHEMBL9305809 0.85 THRA (0.44) NPSR1HSD17B10THRATHRB

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