Iodide

Iodide

SCHEMBL2530877

C[n+]1ccn(-c2ccc(-c3ccc(-n4cc[n+](C)c4)cc3)cc2)c1.[I-].[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 17)

geneUniProtsupporting neighboursconfidence
QDPR P09417 2/20 0.34
PABPC1 P11940 1/20 0.33
APOBEC3A P31941 1/20 0.33
EIF4H Q15056 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
MEN1 O00255 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
KMT2A Q03164 1/20 0.32
SLC6A4 P31645 2/20 0.32
SLC22A2 O15244 1/20 0.32
SLC22A1 O15245 1/20 0.32
SLC22A3 O75751 1/20 0.32
LMNA P02545 1/20 0.30
THRB P10828 1/20 0.30
HPGD P15428 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL12220215 0.98 QDPR (0.35) QDPRPABPC1APOBEC3AEIF4HAPOBEC3G
Iodide SCHEMBL2535721 0.94 LMNA (0.33) MEN1KMT2ALMNATHRBHPGD
SCHEMBL12220256 0.91 LMNA (0.33) MEN1KMT2ALMNATHRBHPGD
Iodide SCHEMBL14738436 0.86 F2 (0.34) MEN1KMT2ALMNA
Iodide SCHEMBL14739461 0.84 NOTUM (0.32) MEN1KMT2A
Iodide SCHEMBL2040900 0.84 HDAC8 (0.41) APOBEC3GALOX15LMNA
SCHEMBL12216496 0.83 SLC22A2 (0.31) QDPRSLC6A4SLC22A2SLC22A1SLC22A3
Iodide SCHEMBL3820106 0.83 LMNA (0.40) APOBEC3AAPOBEC3GMEN1KMT2ASLC6A4
Iodide SCHEMBL15993275 0.82 MGLL (0.39) APOBEC3GMEN1KMT2ALMNA
SCHEMBL15423872 0.82 SLC22A2 (0.39) MEN1ALOX15TSHRKMT2ASLC6A4

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 QDPR 659/4885PABPC1 4252/4885APOBEC3A 2649/4885

“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.