Iodide

Iodide

SCHEMBL4247915

C=CC(=O)CC[N+](C)(C)CC.[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 11)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.31
BBOX1 O75936 7/20 0.48
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.44
DNM1 Q05193 2/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
HSP90AA1 P07900 1/20 0.31
RAD52 P43351 1/20 0.31
APOBEC3A P31941 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31

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
SCHEMBL29270413 0.83 TSHR (0.44) BBOX1ALDH1A1TSHRDNM1HTT
SCHEMBL18690259 0.81 BBOX1 (0.40) BBOX1ALDH1A1TSHR
SCHEMBL9408649 0.79 HTT (0.50) BBOX1ALDH1A1TSHRDNM1HTT
SCHEMBL9408557 0.78 ALDH1A1 (0.48) BBOX1ALDH1A1TSHRDNM1
SCHEMBL902258 0.78 ACHE (0.46) BBOX1ALDH1A1TSHRKMT2AACHE
Hydrochloric Acid SCHEMBL10384120 0.76 HTT (0.52) BBOX1DNM1HTTKMT2AHSP90AA1
Hydrochloric Acid SCHEMBL10383871 0.76 HTT (0.52) BBOX1DNM1HTTKMT2AHSP90AA1
SCHEMBL902256 0.76 ALDH1A1 (0.44) BBOX1ALDH1A1TSHRACHE
Hydrochloric Acid SCHEMBL422093 0.76 ACHE (0.44) BBOX1ALDH1A1TSHRACHEAPOBEC3A
SCHEMBL28854167 0.76 ALDH1A1 (0.50) BBOX1ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1724290-B1 LIQUID COMPOSITION CONTAINING NO SOLVENT NISSHIN SPINNING (JP) 2009-07-08 EP disclosed
US-20070194275-A1 Liquid composition containing no solvent NISSHINBO INDUSTRIES, INC. (JP) 2007-08-23 US disclosed
EP-1724290-A1 LIQUID COMPOSITION CONTAINING NO SOLVENT Nisshinbo Industries, Inc. (JP) 2006-11-22 EP disclosed