Iodide

Iodide

SCHEMBL9306675

CCCCCCCCCCCCCCCCOc1ccc(OCC(=O)NCCc2ccc[n+](C)c2)cc1C(C)(C)C.[I-]

nearest known ligand 0.56

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 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.42
RECQL P46063 1/20 0.42
MTNR1A P48039 2/20 0.41
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39

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 SCHEMBL9306267 1.00 TSHR (0.42) TSHRRECQLMTNR1ATHRATHRB
Iodide SCHEMBL9307104 0.92 MTNR1A (0.40) TSHRRECQLMTNR1ATHRATHRB
Iodide SCHEMBL9307839 0.92 MTNR1A (0.40) TSHRRECQLMTNR1ATHRATHRB
Iodide SCHEMBL9308243 0.91 MTNR1A (0.41) TSHRRECQLMTNR1ATHRATHRB
Iodide SCHEMBL9306494 0.91 MTNR1A (0.41) TSHRRECQLMTNR1ATHRATHRB
Iodide SCHEMBL9306709 0.90 TSHR (0.42) TSHRRECQLTHRATHRBCNR2
Iodide SCHEMBL9307072 0.90 TSHR (0.42) TSHRRECQLTHRATHRBCNR2
Iodide SCHEMBL9306258 0.88 SMN1; SMN2 (0.49) TSHRRECQLSMN1; SMN2CNR2
Iodide SCHEMBL9306466 0.88 ALDH1A1 (0.44) TSHRRECQLMTNR1ASMN1; SMN2CNR1
Iodide SCHEMBL9308265 0.88 SMN1; SMN2 (0.49) TSHRRECQLSMN1; SMN2CNR2

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