Iodide

Iodide

SCHEMBL28520795

I.I.OCCN1CCCC1.OCCN1CCCC1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PTGS1PTGS2

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 5/20 0.50
ALDH1A1 P00352 3/20 0.50
MEN1 O00255 2/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
KDM4E B2RXH2 1/20 0.50
HRH3 Q9Y5N1 1/20 0.48
MAPT P10636 4/20 0.44
POLB P06746 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
CARM1 Q86X55 1/20 0.42
PRMT6 Q96LA8 1/20 0.42
PRMT8 Q9NR22 1/20 0.42
LMNA P02545 2/20 0.41
HTT P42858 1/20 0.41
CYP1A2 P05177 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ATM Q13315 1/20 0.40

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 SCHEMBL28525407 0.97 KMT2A (0.54) KMT2AALDH1A1MEN1CYP3A4CYP2C9
Iodide SCHEMBL28526462 0.97 KMT2A (0.54) KMT2AALDH1A1MEN1CYP3A4CYP2C9
SCHEMBL8387 0.97
SCHEMBL9020695 0.97
SCHEMBL29025500 0.97 ALDH1A1 (0.52) KMT2AALDH1A1MEN1CYP3A4CYP2C9
SCHEMBL14856230 0.94 KMT2A (0.56) KMT2AALDH1A1MEN1CYP3A4CYP2C9
Potassium SCHEMBL31451607 0.94
SCHEMBL7757481 0.94 KMT2A (0.56) KMT2AALDH1A1MEN1CYP3A4CYP2C9
SCHEMBL227313 0.94 KMT2A (0.56) KMT2AALDH1A1MEN1CYP3A4CYP2C9
SCHEMBL19172427 0.94 KMT2A (0.56) KMT2AALDH1A1MEN1CYP3A4CYP2C9

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-112218845-A FOXM1 inhibitor compositions and methods of use thereof 伊利诺伊大学理事会 2021-01-12 CN claimed
CN-112218845-A FOXM1 inhibitor compositions and methods of use thereof 伊利诺伊大学理事会 2021-01-12 CN disclosed