Iodide

Iodide

SCHEMBL9080187

Cc1nc2c(NC(=O)c3c(Cl)cccc3Cl)cccn2c1C[N+](C)(C)C.[I-]

nearest known ligand 0.45

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 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.45
MEN1 O00255 2/20 0.45
CRHBP P24387 1/20 0.45
HTT P42858 1/20 0.45
CRHR2 Q13324 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
RAB9A P51151 2/20 0.39
TYK2 P29597 4/20 0.38
JAK2 O60674 3/20 0.38
JAK1 P23458 3/20 0.38
HPGD P15428 1/20 0.38
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
EPHB3 P54753 2/20 0.37
POLB P06746 1/20 0.37
NPC1 O15118 1/20 0.37
SLC16A3 O15427 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
SCHEMBL9081500 0.99 KMT2A (0.46) KMT2AMEN1CRHBPHTTCRHR2
SCHEMBL9081462 0.86 KMT2A (0.48) KMT2AMEN1CRHBPHTTCRHR2
SCHEMBL9080622 0.84 KMT2A (0.46) KMT2AMEN1CRHBPHTTCRHR2
SCHEMBL9080517 0.84 KMT2A (0.49) KMT2AMEN1CRHBPHTTCRHR2
SCHEMBL9231591 0.83 PTGES (0.46) KMT2AMEN1CRHBPHTTCRHR2
SCHEMBL9080899 0.83 ATP4A (0.47) KMT2AMEN1CRHBPHTTCRHR2
SCHEMBL9081354 0.83 KMT2A (0.48) KMT2AMEN1CRHBPHTTCRHR2
SCHEMBL9080404 0.83 KMT2A (0.48) KMT2AMEN1CRHBPHTTCRHR2
SCHEMBL9081886 0.83 KMT2A (0.45) KMT2AMEN1CRHBPHTTCRHR2
SCHEMBL9082430 0.83 KMT2A (0.45) KMT2AMEN1CRHBPHTTCRHR2

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-1996034866-A1 IMIDAZO 1,2-A PYRIDINE AND IMIDAZO 1,2-A PYRIDEZINE DERIVATIVES AND THEIR USE AS BONE RESORPTION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-11-07 WO disclosed