Iodide

Iodide

SCHEMBL9308739

CCCCCCCCCCCCCCOc1ccc(CN(C(=O)c2cc[n+](CC)cc2)c2ccccc2)cc1OC.[I-]

nearest known ligand 0.51

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 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TSHR P16473 2/20 0.44
ALDH1A1 P00352 1/20 0.44
ALOX15 P16050 1/20 0.44
THRA P10827 1/20 0.44
THRB P10828 1/20 0.44
MCHR1 Q99705 1/20 0.44
KDM4E B2RXH2 1/20 0.43
TP53 P04637 1/20 0.43
MAPK1 P28482 1/20 0.43
STAT3 P40763 1/20 0.42

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 SCHEMBL9307043 1.00 LMNA (0.46) LMNAMEN1MAPTKMT2ANPSR1
Iodide SCHEMBL9306871 0.93 LMNA (0.46) LMNAMEN1MAPTKMT2ANPSR1
Iodide SCHEMBL9306440 0.93 LMNA (0.46) LMNAMEN1MAPTKMT2ANPSR1
Iodide SCHEMBL9307777 0.90 LMNA (0.44) LMNAMEN1MAPTKMT2ANPSR1
Iodide SCHEMBL9307610 0.90 THRA (0.43) THRATHRBSTAT3
Iodide SCHEMBL9307229 0.88 THRA (0.45) THRATHRBSTAT3
Iodide SCHEMBL9305571 0.87 LMNA (0.43) LMNAMEN1MAPTKMT2ANPSR1
Iodide SCHEMBL9307037 0.87 LMNA (0.43) LMNAMEN1MAPTKMT2ANPSR1
Iodide SCHEMBL9307977 0.87 LMNA (0.43) LMNAMEN1MAPTKMT2ANPSR1
Iodide SCHEMBL9305698 0.87 THRA (0.45) TSHRTHRATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5328921-A Antagonist of platelet activating factor AMERICAN CYANAMID COMPANY (US) 1994-07-12 US disclosed