Iodide

Iodide

SCHEMBL9306951

CCCCCCCCCCCCCCOc1ccc(C(CC)NC(=O)c2cc[n+](CC)cc2)cc1C(C)(C)C.[I-]

nearest known ligand 0.45

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 9)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.45
THRB P10828 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PPARG P37231 2/20 0.39
PPARA Q07869 1/20 0.39
SMPD1 P17405 3/20 0.38
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38

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 SCHEMBL9305666 1.00 THRA (0.45) THRATHRBSMN1; SMN2NPSR1PPARG
Iodide SCHEMBL9309375 0.94 THRA (0.45) THRATHRBSMN1; SMN2NPSR1PPARG
Iodide SCHEMBL9307639 0.94 THRA (0.45) THRATHRBSMN1; SMN2NPSR1PPARG
Iodide SCHEMBL9307918 0.94 THRA (0.45) THRATHRBSMN1; SMN2NPSR1PPARG
Iodide SCHEMBL9308099 0.92 THRA (0.46) THRATHRBSMN1; SMN2NPSR1PPARG
Iodide SCHEMBL9306850 0.92 THRA (0.46) THRATHRBSMN1; SMN2NPSR1PPARG
Iodide SCHEMBL9306238 0.89 SMPD1 (0.47) THRATHRBSMN1; SMN2NPSR1SMPD1
Iodide SCHEMBL9306302 0.87 THRA (0.43) THRATHRBSMN1; SMN2NPSR1PPARG
Iodide SCHEMBL9306499 0.87 THRA (0.43) THRATHRBSMN1; SMN2NPSR1PPARG
Iodide SCHEMBL9307547 0.84 SMPD1 (0.47) THRATHRBSMN1; SMN2NPSR1SMPD1

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