Iodide

Iodide

SCHEMBL6728604

CCC[N+](C)(C)C1CCN(c2ccc(N)cc2)C1.CC[N+](C)(C)C1CCN(c2ccc(N)cc2)C1.I

nearest known ligand 0.39

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
MAPT P10636 4/20 0.39
GFER P55789 4/20 0.39
KDM4E B2RXH2 3/20 0.39
GAA P10253 3/20 0.39
RAD52 P43351 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 3/20 0.36
KMT2A Q03164 2/20 0.36
ADRA2C P18825 1/20 0.36
PTK2B Q14289 1/20 0.36
ESR2 Q92731 1/20 0.36
DPP4 P27487 7/20 0.34
HTT P42858 2/20 0.33
GRM2 Q14416 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
USP2 O75604 1/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
THRB P10828 1/20 0.33

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 SCHEMBL3061684 0.96 MAPT (0.42) MAPTGFERKDM4EGAARAD52
SCHEMBL2271831 0.95 MAPT (0.43) MAPTGFERKDM4EGAARAD52
Bromide SCHEMBL2538000 0.93 MAPT (0.42) MAPTGFERKDM4EGAARAD52
Iodide SCHEMBL2537434 0.93 MAPT (0.42) MAPTGFERKDM4EGAARAD52
Bromide SCHEMBL5249202 0.93 MAPT (0.42) MAPTGFERKDM4EGAARAD52
SCHEMBL2267487 0.92 MAPT (0.45) MAPTGFERKDM4EGAARAD52
Iodide SCHEMBL2533972 0.91 MAPT (0.44) MAPTGFERKDM4EGAARAD52
Hydrochloric Acid SCHEMBL3059271 0.91 MAPT (0.44) MAPTGFERKDM4EGAARAD52
Hydrochloric Acid SCHEMBL2542727 0.91 MAPT (0.44) MAPTGFERKDM4EGAARAD52
Hydrochloric Acid SCHEMBL6405819 0.89 MAPT (0.43) MAPTGFERKDM4EGAARAD52

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-20040216245-A1 Dyeing composition comprising a cationic tertiary para-phenylenediamine and a para-aminophenol, methods and uses L'OREAL (FR) 2004-11-04 US claimed

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-20040216245-A1 Dyeing composition comprising a cationic tertiary para-phenylenediamine and a para-aminophenol, methods and uses KRT18, CDC73, NUP205 MAPT 1322/4885GFER 2915/4885KDM4E 1079/4885

“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.