Iodide

Iodide

SCHEMBL3710697

CCCCCCN(CCCCCC)c1ccc2c(c1)Sc1ccccc1N2.CCCCCCN(CCCCCC)c1ccc2c(c1)Sc1ccccc1N2.CCCCCCN(CCCCCC)c1ccc2c(c1)Sc1ccccc1N2.I.I.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 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 2/20 0.44
NOX1 Q9Y5S8 11/20 0.48
GAA P10253 7/20 0.45
MAPT P10636 6/20 0.45
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
TDP1 Q9NUW8 3/20 0.45
MAPK1 P28482 2/20 0.45
LMNA P02545 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
SNCA P37840 3/20 0.44
ALOX15 P16050 3/20 0.44
BCHE P06276 2/20 0.44
POLB P06746 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
ALOX12 P18054 1/20 0.44

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 SCHEMBL3710701 1.00 NOX1 (0.48) NOX1GAAMAPTMEN1KMT2A
Iodide SCHEMBL3710699 1.00 NOX1 (0.48) NOX1GAAMAPTMEN1KMT2A
Iodide SCHEMBL1470930 0.99 NOX1 (0.49) NOX1GAAMAPTMEN1KMT2A
Iodide SCHEMBL3714596 0.95 NOX1 (0.50) NOX1GAAMAPTMEN1KMT2A
Iodide SCHEMBL3714593 0.95 NOX1 (0.50) NOX1GAAMAPTMEN1KMT2A
Iodide SCHEMBL3714591 0.95 NOX1 (0.50) NOX1GAAMAPTMEN1KMT2A
SCHEMBL1470385 0.89 SNCA (0.37) NOX1GAAMAPTMEN1KMT2A
Iodide SCHEMBL3711286 0.89 NOX1 (0.53) NOX1GAAMAPTMEN1KMT2A
Iodide SCHEMBL1471046 0.89 NOX1 (0.53) NOX1GAAMAPTMEN1KMT2A
Iodide SCHEMBL3711284 0.89 NOX1 (0.53) NOX1GAAMAPTMEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110306576-A1 COMPOUNDS AND METHODS RELATING THERETO PHARMALUCIA LIMITED (GB) 2011-12-15 US disclosed
WO-2010097626-A2 COMPOUNDS AND METHODS RELATING THERETO PHARMALUCIA LIMITED (GB) 2010-09-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110306576-A1 COMPOUNDS AND METHODS RELATING THERETO QSOX1, PYM1, SQOR ACHE 1759/4885NOX1 94/4885GAA 3611/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.