Iodide

Iodide

SCHEMBL31147101

CC(=O)NC=CC1Sc2ccccc2N1C.I

nearest known ligand 0.40

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 19)

geneUniProtsupporting neighboursconfidence
▸ ACHE known ✓ P22303 1/20 0.33
▸ MTNR1A P48039 2/20 0.37
▸ MTNR1B P49286 2/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ NOX1 Q9Y5S8 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ GSK3B P49841 1/20 0.34
▸ MAPT P10636 2/20 0.34
▸ PDF Q9HBH1 2/20 0.34
▸ BCHE P06276 3/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ HDAC7 Q8WUI4 1/20 0.33
▸ HDAC5 Q9UQL6 1/20 0.33
▸ POLB P06746 1/20 0.32

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
SCHEMBL11289317 0.76 MAOA (0.33) MEN1KMT2ASMN1; SMN2MAPTBCHE
SCHEMBL31151816 0.76 MAOA (0.39) MEN1KMT2ANOX1SMN1; SMN2GSK3B
SCHEMBL27516784 0.74 MAOA (0.41) NOX1SMN1; SMN2GSK3BBCHE
SCHEMBL28820660 0.72 BCHE (0.39) MAPTBCHELMNAPOLB
SCHEMBL28820816 0.72 BCHE (0.39) MAPTBCHELMNAPOLB
SCHEMBL29815013 0.70 APP (0.35) KMT2ASMN1; SMN2MAPTBCHE
SCHEMBL30846519 0.70 GSK3B (0.42) MEN1KMT2ANOX1SMN1; SMN2GSK3B
SCHEMBL27987207 0.70 MAOA (0.39) MEN1KMT2ANOX1SMN1; SMN2GSK3B
SCHEMBL27870759 0.70 MAOA (0.39) SMN1; SMN2GSK3BMAPT
SCHEMBL31231823 0.69 TP53 (0.39) MEN1KMT2ANOX1SMN1; SMN2MAPT

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
CN-118702692-A Preparation method of benzothiazole tetrafluoroborate fluorescent dye 苏州络森生物科技有限公司 2024-09-27 — — CN disclosed
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