Iodide

Iodide

SCHEMBL9305622

CCCCCCCCCCCCCCOc1ccc(COC(=O)N(Cc2ccc[n+](CC)c2)C(C)=O)cc1Cl.[I-]

nearest known ligand 0.54

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 6)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.48
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 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 SCHEMBL9306819 0.94 ATM (0.48) ATMMEN1LMNAMAPTMAPK1
Iodide SCHEMBL9306915 0.91 ATM (0.50) ATM
Iodide SCHEMBL9305211 0.91
Iodide SCHEMBL9308411 0.90 ATM (0.42) ATM
Iodide SCHEMBL9306950 0.90 ATM (0.52) ATM
Iodide SCHEMBL9305734 0.88 THRA (0.41)
Iodide SCHEMBL9306628 0.88 ATM (0.40) ATMMEN1LMNAMAPTMAPK1
Iodide SCHEMBL9306097 0.86 ATM (0.52) ATMMEN1LMNAMAPTMAPK1
Iodide SCHEMBL9307605 0.86
Iodide SCHEMBL9306937 0.85 ATM (0.53) ATM

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