Iodide

Iodide

SCHEMBL3660488

CN[C@@H](CCSC)C(=O)O.I.S

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 16)

geneUniProtsupporting neighboursconfidence
RNPEP Q9H4A4 1/20 0.48
LMNA P02545 2/20 0.47
ALDH1A1 P00352 3/20 0.44
NPSR1 Q6W5P4 1/20 0.44
KDM4E B2RXH2 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PKM P14618 1/20 0.43
GAA P10253 1/20 0.43
FOLH1 Q04609 1/20 0.42
CA2 P00918 2/20 0.42
MAPK1 P28482 2/20 0.42
CA1 P00915 1/20 0.42
USP2 O75604 1/20 0.41
TP53 P04637 1/20 0.41
ALOX15 P16050 1/20 0.41
RAB9A P51151 1/20 0.41

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 SCHEMBL3660485 1.00 RNPEP (0.48) RNPEPLMNAALDH1A1NPSR1KDM4E
Hydrogen Sulfide SCHEMBL11572294 0.98 RNPEP (0.50) RNPEPLMNAALDH1A1NPSR1KDM4E
Hydrogen Sulfide SCHEMBL1498068 0.98 RNPEP (0.50) RNPEPLMNAALDH1A1NPSR1KDM4E
Hydrogen Sulfide SCHEMBL1498065 0.98 RNPEP (0.50) RNPEPLMNAALDH1A1NPSR1KDM4E
Iodide SCHEMBL3658380 0.98 RNPEP (0.50) RNPEPLMNAALDH1A1NPSR1KDM4E
Iodide SCHEMBL3658381 0.98 RNPEP (0.50) RNPEPLMNAALDH1A1NPSR1KDM4E
Water SCHEMBL7531314 0.96 RNPEP (0.48) RNPEPLMNAALDH1A1NPSR1KDM4E
Hydrochloric Acid SCHEMBL232286 0.96 RNPEP (0.48) RNPEPLMNAALDH1A1NPSR1KDM4E
Hydrochloric Acid SCHEMBL349508 0.96 RNPEP (0.48) RNPEPLMNAALDH1A1NPSR1KDM4E
Bromide SCHEMBL1498083 0.96 RNPEP (0.48) RNPEPLMNAALDH1A1NPSR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2209390-A1 COMPLEX PRODUCT WITH ADVANCED ASSIMILATION EFFICACY FOR HUMANS AND ITS UTILIZATION Ficsur, Tibor (HU) 2010-07-28 EP claimed
WO-2009040590-A1 COMPLEX PRODUCT WITH ADVANCED ASSIMILATION EFFICACY FOR HUMANS AND ITS UTILIZATION FICSUR TIBOR (HU) 2009-04-02 WO claimed
EP-2209390-A1 COMPLEX PRODUCT WITH ADVANCED ASSIMILATION EFFICACY FOR HUMANS AND ITS UTILIZATION Ficsur, Tibor (HU) 2010-07-28 EP disclosed
WO-2009040590-A1 COMPLEX PRODUCT WITH ADVANCED ASSIMILATION EFFICACY FOR HUMANS AND ITS UTILIZATION FICSUR TIBOR (HU) 2009-04-02 WO disclosed