Iodide

Iodide

SCHEMBL4672201

I.I.I.I.N[C@@H](Cc1ccc(Oc2ccc(O)cc2)cc1)C(=O)O

nearest known ligand 0.77

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
SLC7A5 Q01650 4/20 0.77
PCNA P12004 2/20 0.66
PTGS1 P23219 2/20 0.57
KDM4E B2RXH2 1/20 0.57
USP2 O75604 1/20 0.57
EGFR P00533 1/20 0.57
LCK P06239 1/20 0.57
FYN P06241 1/20 0.57
ADORA3 P0DMS8 1/20 0.57
ALOX15 P16050 1/20 0.57
HTR2A P28223 1/20 0.57
PTGS2 P35354 1/20 0.57
RECQL P46063 1/20 0.57
HIF1A Q16665 1/20 0.57
HSD17B10 Q99714 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
PTPN1 P18031 1/20 0.56
ALPI P09923 1/20 0.56
PKM P14618 1/20 0.56
XIAP P98170 1/20 0.56

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 SCHEMBL4670395 1.00 SLC7A5 (0.77) SLC7A5PCNAPTGS1KDM4EUSP2
SCHEMBL29556905 0.98 SLC7A5 (0.80) SLC7A5PCNAPTGS1KDM4EUSP2
SCHEMBL30622075 0.98 SLC7A5 (0.80) SLC7A5PCNAPTGS1KDM4EUSP2
SCHEMBL285217 0.98 SLC7A5 (0.80) SLC7A5PCNAPTGS1KDM4EUSP2
SCHEMBL285216 0.98 SLC7A5 (0.80) SLC7A5PCNAPTGS1KDM4EUSP2
SCHEMBL28173375 0.97 SLC7A5 (0.77) SLC7A5PCNAPTGS1KDM4EUSP2
SCHEMBL29455798 0.97 SLC7A5 (0.77) SLC7A5PCNAPTGS1KDM4EUSP2
Tyrosine SCHEMBL9398209 0.90 SLC7A5 (0.96) SLC7A5PCNAPTGS1KDM4EUSP2
Tyrosine SCHEMBL5929832 0.90 SLC7A5 (0.96) SLC7A5PCNAPTGS1KDM4EUSP2
Tyrosine SCHEMBL9398203 0.90 SLC7A5 (0.96) SLC7A5PCNAPTGS1KDM4EUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1996013-A2 METHODS AND COMPOSITIONS FOR ORGAN AND TISSUE FUNCTIONALITY Dask Technologies, LLC (US) 2008-12-03 EP disclosed
EP-1940424-A2 COMPOSITIONS AND METHODS FOR THE AUGMENTATION AND REPAIR OF DEFECTS IN TISSUE Dask Technologies, LLC (US) 2008-07-09 EP disclosed
WO-2007035843-A2 METHODS AND COMPOSITIONS FOR ORGAN AND TISSUE FUNCTIONALITY DASK TECHNOLOGIES, LLC (US) 2007-03-29 WO disclosed
WO-2007035363-A2 COMPOSITIONS AND METHODS FOR THE AUGMENTATION AND REPAIR OF DEFECTS IN TISSUE DASK TECHNOLOGIES, LLC (US) 2007-03-29 WO disclosed
US-20070065415-A1 Compositions and methods for the augmentation and repair of defects in tissue DASK TECHNOLOGIES, LLC 2007-03-22 US disclosed