Iodide

Iodide

SCHEMBL5574102

Cc1c2c(cc[n+]1C)C=CC1(O2)N(C)c2ccccc2C1(C)C.[I-]

nearest known ligand 0.53

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
MAPT P10636 9/20 0.53
GAA P10253 4/20 0.53
LMNA P02545 4/20 0.53
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
NPSR1 Q6W5P4 3/20 0.53
RECQL P46063 3/20 0.53
TDP1 Q9NUW8 3/20 0.53
ALOX15 P16050 2/20 0.53
ALPG P10696 1/20 0.53
TP53 P04637 1/20 0.53
HSD17B10 Q99714 1/20 0.53
THRB P10828 5/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
PKM P14618 2/20 0.37
PLIN1 O60240 1/20 0.37
TSHR P16473 1/20 0.37
PLIN5 Q00G26 1/20 0.37
ABHD5 Q8WTS1 1/20 0.37
KDM4E B2RXH2 6/20 0.37

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
SCHEMBL12852039 1.00 MAPT (0.53) MAPTGAALMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL5573265 0.99 MAPT (0.52) MAPTGAALMNAMEN1KMT2A
Water SCHEMBL5569658 0.99 MAPT (0.52) MAPTGAALMNAMEN1KMT2A
SCHEMBL8681138 0.81 MAPT (0.57) MAPTGAALMNAMEN1KMT2A
SCHEMBL8682613 0.80 MAPT (0.56) MAPTGAALMNAMEN1KMT2A
SCHEMBL5574082 0.79 MAPT (0.55) MAPTGAALMNAMEN1KMT2A
SCHEMBL8680295 0.77 MAPT (0.62) MAPTGAALMNAMEN1KMT2A
SCHEMBL8680678 0.77 MAPT (0.56) MAPTGAALMNAMEN1KMT2A
SCHEMBL8680325 0.77 MAPT (0.56) MAPTGAALMNAMEN1KMT2A
SCHEMBL12852038 0.76 MAPT (0.45) MAPTGAALMNAMEN1KMT2A

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-8277749-B2 Time-temperature indicator based on valence isomerizations FRESHPOINT HOLDINGS S.A. (CH) 2012-10-02 US disclosed
US-20070172951-A1 Time-temperature indicator based on valence isomerizations FRESHPOINT QUALITY ASSURANCE LTD. (IL) 2007-07-26 US disclosed