Iodide

Iodide

SCHEMBL2530883

C[n+]1ccn(CCCCn2cc[n+](C)c2)c1.[I-].[I-]

nearest known ligand 0.76

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 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.74
MEN1 O00255 2/20 0.74
HSP90AA1 P07900 2/20 0.74
KMT2A Q03164 2/20 0.74
APAF1 O14727 1/20 0.74
NPC1 O15118 1/20 0.74
PLA2G1B P04054 1/20 0.74
MAPT P10636 1/20 0.74
MAPK1 P28482 1/20 0.74
HTT P42858 1/20 0.74
RAB9A P51151 1/20 0.74
NPSR1 Q6W5P4 1/20 0.74
ATG4B Q9Y4P1 1/20 0.74
FDPS P14324 13/20 0.40
LMNA P02545 1/20 0.38
PON1 P27169 1/20 0.35

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 SCHEMBL2529357 0.98 SMN1; SMN2 (0.78) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Iodide SCHEMBL2530038 0.98 SMN1; SMN2 (0.78) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Iodide SCHEMBL2531359 0.98 SMN1; SMN2 (0.78) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Iodide SCHEMBL2533638 0.98 SMN1; SMN2 (0.78) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Iodide SCHEMBL2535593 0.98 SMN1; SMN2 (0.78) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Iodide SCHEMBL2531281 0.98 SMN1; SMN2 (0.78) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Iodide SCHEMBL2532277 0.98 SMN1; SMN2 (0.78) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Iodide SCHEMBL2526029 0.98 SMN1; SMN2 (0.78) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Iodide SCHEMBL2532625 0.98 SMN1; SMN2 (0.78) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
SCHEMBL9927858 0.98 SMN1; SMN2 (0.77) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1

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-8632914-B2 Triazolium and imidazolium salts and uses thereof UNIVERSITY HEALTH NETWORK (CA) 2014-01-21 US disclosed
US-20110257235-A1 TRIAZOLIUM AND IMIDAZOLIUM SALTS AND USES THEREOF UNIVERSITY HEALTH NETWORK (CA) 2011-10-20 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-20110257235-A1 TRIAZOLIUM AND IMIDAZOLIUM SALTS AND USES THEREOF ARG2, ARG1, CIT SMN1; SMN2 2620/4885MEN1 3327/4885HSP90AA1 1502/4885

“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.