Iodide

Iodide

SCHEMBL3434471

C=CCNc1cccc(C)c1C.I

nearest known ligand 0.46

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
CHRM1 known ✓ P11229 1/20 0.37
MAPT P10636 6/20 0.46
TP53 P04637 3/20 0.46
GAA P10253 3/20 0.46
MAPK1 P28482 2/20 0.46
HSD17B10 Q99714 2/20 0.46
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
RAPGEF4 Q8WZA2 1/20 0.41
ALDH1A1 P00352 6/20 0.40
KMT2A Q03164 4/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
HTT P42858 1/20 0.39
LMNA P02545 3/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2D6 P10635 1/20 0.39
HDAC3 O15379 1/20 0.37
HDAC4 P56524 1/20 0.37

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
SCHEMBL8661772 0.98 MAPT (0.47) MAPTTP53GAAMAPK1HSD17B10
Hydrochloric Acid SCHEMBL29259617 0.96 MAPT (0.46) MAPTTP53GAAMAPK1HSD17B10
SCHEMBL17865619 0.88 ALDH1A1 (0.37) MAPTTP53GAAMAPK1HSD17B10
SCHEMBL1485712 0.82 MAPT (0.59) MAPTTP53GAAALDH1A1KMT2A
Hydrochloric Acid SCHEMBL2866031 0.81 MAPT (0.57) MAPTTP53GAAALDH1A1KMT2A
SCHEMBL15928718 0.80 CYP3A4 (0.45) MAPTTP53GAAMAPK1HSD17B10
SCHEMBL9273078 0.80 MAPT (0.45) MAPTTP53GAAMAPK1HSD17B10
SCHEMBL6474538 0.79 MAPT (0.47) MAPTTP53GAAMAPK1HSD17B10
SCHEMBL11245637 0.76 GAA (0.41) MAPTTP53GAAALDH1A1KMT2A
SCHEMBL11170519 0.76 MAPT (0.67) MAPTTP53GAAMAPK1HSD17B10

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-20100004202-A1 Quaternary ammonium-functionalized-POSS compounds NDSU RESEARCH FOUNDATION 2010-01-07 US 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-20100004202-A1 Quaternary ammonium-functionalized-POSS compounds ARG1, SAE1, RBX1 CHRM1 169/4885MAPT 4210/4885TP53 1158/4885

“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.