Iodide

Iodide

SCHEMBL5086927

CCCCC(CCCC)C(P)(CCCC)CCCC.I

nearest known ligand 0.35

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
FDPS P14324 1/20 0.35
DNM1 Q05193 2/20 0.33
ALDH1A1 P00352 2/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL2834536 0.98 FDPS (0.36) FDPSDNM1ALDH1A1TDP1
Iodide SCHEMBL5085067 0.96 FDPS (0.41) FDPSDNM1
Iodide SCHEMBL5091777 0.96 FDPS (0.33) FDPSDNM1
Hydrochloric Acid SCHEMBL1977248 0.95 FDPS (0.35) FDPSDNM1ALDH1A1TDP1
Bromide SCHEMBL3043996 0.95 FDPS (0.35) FDPSDNM1ALDH1A1TDP1
Iodide SCHEMBL5087217 0.94 FDPS (0.44) FDPSDNM1
Iodide SCHEMBL5092266 0.94 FDPS (0.44) FDPSDNM1
Iodide SCHEMBL5139817 0.94 FDPS (0.44) FDPSDNM1
Iodide SCHEMBL5086930 0.94 FDPS (0.44) FDPSDNM1
Iodide SCHEMBL5087045 0.94 FDPS (0.44) FDPSDNM1

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-20080214386-A1 Stability; easily separated from solution; surface treatment of catalyst with Group seven compound; reacting epoxide with carbon dioxide NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2008-09-04 US disclosed