Iodide

Iodide

SCHEMBL9437122

CC[n+]1c(C=CC=CC=CN(C(C)=O)c2ccccc2)sc2ccccc21.[I-]

nearest known ligand 0.98

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
▸ KMT2A Q03164 9/20 0.98
▸ MAPT P10636 8/20 0.98
▸ MEN1 O00255 8/20 0.98
▸ ALDH1A1 P00352 6/20 0.98
▸ ALOX12 P18054 2/20 0.98
▸ CTNNB1 P35222 2/20 0.98
▸ CYP1A2 P05177 1/20 0.98
▸ CYP3A4 P08684 1/20 0.98
▸ CYP2D6 P10635 1/20 0.98
▸ CYP2C9 P11712 1/20 0.98
▸ CYP2C19 P33261 1/20 0.98
▸ HTT P42858 6/20 0.75
▸ LMNA P02545 5/20 0.75
▸ BLM P54132 5/20 0.75
▸ THRB P10828 4/20 0.75
▸ KDM4E B2RXH2 4/20 0.75
▸ POLB P06746 4/20 0.75
▸ MAPK1 P28482 3/20 0.75
▸ SMN1; SMN2 Q16637 3/20 0.75
▸ TDP1 Q9NUW8 2/20 0.75

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 SCHEMBL9437119 1.00 KMT2A (0.98) KMT2AMAPTMEN1ALDH1A1ALOX12
Iodide SCHEMBL5329489 0.99 KMT2A (1.00) KMT2AMAPTMEN1ALDH1A1ALOX12
SCHEMBL13646783 0.99 KMT2A (0.96) KMT2AMAPTMEN1ALDH1A1ALOX12
Iodide SCHEMBL5329486 0.99 KMT2A (1.00) KMT2AMAPTMEN1ALDH1A1ALOX12
SCHEMBL12821744 0.98 KMT2A (0.98) KMT2AMAPTMEN1ALDH1A1ALOX12
SCHEMBL12821746 0.98 KMT2A (0.98) KMT2AMAPTMEN1ALDH1A1ALOX12
Perchlorate SCHEMBL10521396 0.94 MAPT (0.90) KMT2AMAPTMEN1ALDH1A1ALOX12
Iodide SCHEMBL8067949 0.92 MAPT (0.87) KMT2AMAPTMEN1ALDH1A1ALOX12
Iodide SCHEMBL9768656 0.92 MAPT (0.87) KMT2AMAPTMEN1ALDH1A1ALOX12
Perchlorate SCHEMBL11638443 0.87 MAPT (0.78) KMT2AMAPTMEN1ALDH1A1ALOX12

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-5294709-A Methine compounds and methine dyes FUJI PHOTO FILM CO., LTD. (JP) 1994-03-15 — — US disclosed
US-5032500-A Adding sensitizing dye containing for inhibitor after grain formation and before ripening FUJI PHOTO FILM CO., LTD. (JP) 1991-07-16 — — US disclosed
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