Iodide

Iodide

SCHEMBL31385461

I.I.Nc1nccc(-c2ccncc2)c1N

nearest known ligand 0.46

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
CHRM1 known ✓ P11229 1/20 0.37
MAPT P10636 4/20 0.46
NOS3 P29474 1/20 0.43
NOS2 P35228 1/20 0.43
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
GFER P55789 1/20 0.39
AURKB Q96GD4 2/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
AURKA O14965 1/20 0.39
KDR P35968 1/20 0.39
FYN P06241 1/20 0.38
PIK3CA P42336 2/20 0.38
CHEK2 O96017 1/20 0.37
CYP2D6 P10635 2/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL5973721 0.98 MAPT (0.47) MAPTNOS3NOS2LMNASMN1; SMN2
SCHEMBL1165179 0.81 GSK3B (0.47) MAPTNOS3NOS2LMNAAURKB
SCHEMBL30513239 0.78 MAPT (0.50) MAPTLMNASMN1; SMN2NPC1RAB9A
SCHEMBL11901650 0.78 MAP4K4 (0.46) NOS3NOS2LMNANPC1RAB9A
SCHEMBL13730604 0.78 NOS3 (0.52) MAPTNOS3NOS2LMNANPC1
SCHEMBL17555671 0.78 CDK2 (0.43) MAPTNOS3NOS2SMN1; SMN2GFER
SCHEMBL3243063 0.77 KIF11 (0.47) NOS3NOS2MAP4K4
SCHEMBL5319523 0.75 NOS2 (0.44) NOS3NOS2LMNASMN1; SMN2NPC1
SCHEMBL17565133 0.75 CYP2A6 (0.50) MAPTLMNASMN1; SMN2CHEK2CYP2D6
SCHEMBL17555583 0.75 CYP2A6 (0.50) NOS3NOS2KDRCHEK2IMPDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122037215-A Molecular imprinting hydrogen bond organic framework adsorption material and preparation method and application thereof 重庆市食品药品检验检测研究院 2026-05-15 CN claimed
CN-119119501-A Three-component hydrogen bond organic framework material and preparation method and application thereof 陕西科技大学 2024-12-13 CN claimed
CN-122037215-A Molecular imprinting hydrogen bond organic framework adsorption material and preparation method and application thereof 重庆市食品药品检验检测研究院 2026-05-15 CN disclosed
CN-119119501-A Three-component hydrogen bond organic framework material and preparation method and application thereof 陕西科技大学 2024-12-13 CN disclosed