Iodide

Iodide

SCHEMBL3010355

CN(C)CCCN1C=CC(=Cc2sc3ccccc3[n+]2C)c2ccccc21.I.[CH2]CC[N+](C)(C)CCCN1C=CC(=Cc2sc3ccccc3[n+]2C)c2ccccc21.[I-].[I-].[I-]

nearest known ligand 0.33

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 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HTT P42858 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ MCL1 Q07820 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ SNCA P37840 1/20 0.31
▸ THRB P10828 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30

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 SCHEMBL3662105 0.90 MAPT (0.39) MEN1MAPTHTTKMT2ASMN1; SMN2
Iodide SCHEMBL17350237 0.90 MAPT (0.39) MEN1MAPTHTTKMT2ASMN1; SMN2
Iodide SCHEMBL29072731 0.89 MAPT (0.39) MEN1MAPTHTTKMT2ASMN1; SMN2
Iodide SCHEMBL2682814 0.88 MAPT (0.39) MEN1MAPTHTTKMT2ASMN1; SMN2
SCHEMBL3786410 0.87 MAPT (0.38) MEN1MAPTHTTKMT2ASMN1; SMN2
Iodide SCHEMBL5918788 0.86 MAPT (0.38) MEN1MAPTHTTKMT2ASMN1; SMN2
SCHEMBL3944198 0.85 MAPT (0.36) MEN1MAPTHTTKMT2ASMN1; SMN2
SCHEMBL3944197 0.85 MAPT (0.36) MEN1MAPTHTTKMT2ASMN1; SMN2
SCHEMBL13983891 0.84 MAPT (0.36) MEN1MAPTHTTKMT2ASMN1; SMN2
Iodide SCHEMBL30216122 0.84 MAPT (0.40) MEN1MAPTHTTKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8455209-B2 Reagent and reagent kit for analysis of immature leukocyte SYSMEX CORPORATION (JP) 2013-06-04 — — US claimed
US-20100184061-A1 REAGENT AND REAGENT KIT FOR ANALYSIS OF IMMATURE LEUKOCYTE SYSMEX CORORATION (JP) 2010-07-22 — — US claimed
EP-2166353-A1 REAGENT AND REAGENT KIT FOR ANALYSIS OF PRIMITIVE LEUKOCYTE Sysmex Corporation (JP) 2010-03-24 — — EP claimed
US-10578603-B2 Blood analyzer, blood analyzing method, and non-transitory storage medium SYSMEX CORPORATION (JP) 2020-03-03 — — US disclosed
US-20150369793-A1 BLOOD ANALYZER, BLOOD ANALYZING METHOD, AND NON-TRANSITORY STORAGE MEDIUM SYSMEX CORPORATION (JP) 2015-12-24 — — US disclosed
US-8455209-B2 Reagent and reagent kit for analysis of immature leukocyte SYSMEX CORPORATION (JP) 2013-06-04 — — US disclosed
US-20100184061-A1 REAGENT AND REAGENT KIT FOR ANALYSIS OF IMMATURE LEUKOCYTE SYSMEX CORORATION (JP) 2010-07-22 — — US disclosed
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