Iodide

Iodide

SCHEMBL6660089

CCOc1ccc2c(c1)sc(SC)[n+]2C.[I-]

nearest known ligand 0.43

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
▸ MAPT P10636 9/20 0.43
▸ POLB P06746 1/20 0.43
▸ PSMB8 P28062 1/20 0.41
▸ ALDH1A1 P00352 5/20 0.40
▸ KMT2A Q03164 5/20 0.40
▸ HSD17B10 Q99714 3/20 0.40
▸ TP53 P04637 2/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ LMNA P02545 5/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ PKM P14618 2/20 0.40
▸ APOBEC3A P31941 1/20 0.39
▸ L3MBTL1 Q9Y468 3/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ TDP1 Q9NUW8 3/20 0.38
▸ HTT P42858 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.36
▸ CA12 O43570 1/20 0.36

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
SCHEMBL11516370 0.82 MAPT (0.50) MAPTPOLBPSMB8ALDH1A1KMT2A
SCHEMBL9031549 0.78 LMNA (0.53) MAPTPOLBPSMB8ALDH1A1KMT2A
Iodide SCHEMBL6663647 0.74 SMN1; SMN2 (0.38) MAPTPOLBALDH1A1KMT2ATSHR
SCHEMBL30924937 0.72 ALDH1A1 (0.33) MAPTPOLBALDH1A1KMT2AMEN1
SCHEMBL22190283 0.71 MAPT (0.40) MAPTPOLBPSMB8ALDH1A1KMT2A
Iodide SCHEMBL7335651 0.71 MAPT (0.47) MAPTPOLBALDH1A1KMT2AHSD17B10
SCHEMBL12301906 0.70 PIK3CA (0.37) MAPTPOLBALDH1A1KMT2AHSD17B10
SCHEMBL13652085 0.70 MAPT (0.67) MAPTPOLBPSMB8ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL11516847 0.69 INSR (0.50) MAPTPOLBPSMB8ALDH1A1KMT2A
SCHEMBL19305186 0.69 APP (0.64) POLBPSMB8ALDH1A1KMT2AHSD17B10

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
WO-2004010761-A2 PESTICIDAL CYANINE DYE DERIVATIVES FMC CORPORATION (US) 2004-02-05 — — WO disclosed
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