Iodide

Iodide

SCHEMBL30177504

CN(C)c1ccc(/C=C/C=C/C2=[N+](CCO)c3ccc4ccccc4c3C2(C)C)cc1.[I-]

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 0.41
CHRM3 known ✓ P20309 1/20 0.41
ACHE known ✓ P22303 1/20 0.39
PRMT1 Q99873 9/20 0.46
PRMT5 O14744 1/20 0.42
PRMT8 Q9NR22 1/20 0.42
BLM P54132 5/20 0.41
MLNR O43193 1/20 0.41
NR1I2 O75469 1/20 0.41
PGR P06401 1/20 0.41
ADRB1 P08588 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
DRD2 P14416 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41
CNR1 P21554 1/20 0.41
DRD1 P21728 1/20 0.41
TBXA2R P21731 1/20 0.41
SLC6A2 P23975 1/20 0.41
HRH2 P25021 1/20 0.41

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 SCHEMBL22542610 0.87 PRMT1 (0.54) PRMT1PRMT5PRMT8BLMMLNR
Iodide SCHEMBL22542611 0.84 MEN1 (0.49) PRMT1BLMS100A4MAPTMEN1
SCHEMBL22560153 0.83 MEN1 (0.50) PRMT1BLMS100A4MAPTMEN1
Iodide SCHEMBL22542614 0.82 PRMT1 (0.53) PRMT1BLMS100A4MAPTMEN1
Iodide SCHEMBL22542615 0.82 PRMT1 (0.53) PRMT1BLMS100A4MAPTMEN1
Iodide SCHEMBL22542623 0.81 MAPT (0.52) PRMT1PRMT5PRMT8BLMS100A4
Iodide SCHEMBL22542622 0.81 MAPT (0.52) PRMT1PRMT5PRMT8BLMS100A4
SCHEMBL24446420 0.80 MAPT (0.44) PRMT1PRMT5PRMT8BLMMLNR
SCHEMBL24437495 0.79 MLNR (0.53) PRMT1PRMT5PRMT8BLMMLNR
Iodide SCHEMBL22542632 0.78 MEN1 (0.50) PRMT1BLMS100A4MAPTMEN1

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
CN-115611798-B PH trigger charge reversible fluorescent probe and application thereof in cell imaging 齐鲁工业大学 2024-06-14 CN disclosed
CN-115611798-A pH triggered charge reversible fluorescent probe and application thereof in cell imaging 齐鲁工业大学 2023-01-17 CN disclosed