Iodide

Iodide

SCHEMBL9306636

CCCCCCCCCCOc1ccc(C(=O)NCc2cc[n+](C)cc2)cc1Cl.[I-]

nearest known ligand 0.64

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 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
THRA P10827 1/20 0.51
THRB P10828 1/20 0.51
SMPD1 P17405 6/20 0.48
S1PR2 O95136 1/20 0.48
S1PR1 P21453 1/20 0.48
S1PR3 Q99500 1/20 0.48
LPAR2 Q9HBW0 1/20 0.48
CNR2 P34972 1/20 0.47
APOBEC3A P31941 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
APOBEC3G Q9HC16 1/20 0.46

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 SCHEMBL9307333 1.00 POLB (0.52) POLBTHRATHRBSMPD1S1PR2
Iodide SCHEMBL9306976 0.92 POLB (0.52) POLBTHRATHRBSMPD1S1PR2
Iodide SCHEMBL9307073 0.92 POLB (0.52) POLBTHRATHRBSMPD1S1PR2
Iodide SCHEMBL9307700 0.92 POLB (0.52) POLBTHRATHRBSMPD1S1PR2
Iodide SCHEMBL9305943 0.92 POLB (0.52) POLBTHRATHRBSMPD1S1PR2
Iodide SCHEMBL9307306 0.90 S1PR2 (0.55) THRATHRBS1PR2S1PR1S1PR3
Iodide SCHEMBL9307440 0.90 S1PR2 (0.55) THRATHRBS1PR2S1PR1S1PR3
Iodide SCHEMBL9306301 0.89 POLB (0.52) POLBTHRATHRBSMPD1S1PR2
Iodide SCHEMBL9306396 0.89 POLB (0.52) POLBTHRATHRBSMPD1S1PR2
Iodide SCHEMBL9307915 0.88 SMPD1 (0.59) SMPD1CNR2

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