Lithium Ion

Lithium Ion

SCHEMBL700121

O=C([O-])c1cccc2c1c(CN[C@H]1CN3CCC1CC3)nn2-c1ccc(F)cc1.[Li+]

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of Lithium Ion. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CCR1 P32246 5/20 0.38
GAA P10253 2/20 0.36
SMN1; SMN2 Q16637 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
Lithium Ion SCHEMBL701964 1.00 MEN1 (0.47) MEN1KMT2ACCR1GAASMN1; SMN2
SCHEMBL4313992 0.91 MEN1 (0.49) MEN1KMT2ACCR1GAASMN1; SMN2
SCHEMBL1672736 0.91 MEN1 (0.49) MEN1KMT2ACCR1GAASMN1; SMN2
SCHEMBL1672735 0.91 MEN1 (0.49) MEN1KMT2ACCR1GAASMN1; SMN2
SCHEMBL700122 0.90 MEN1 (0.48) MEN1KMT2ACCR1GAASMN1; SMN2
SCHEMBL702594 0.89 MEN1 (0.47) MEN1KMT2ACCR1
SCHEMBL702595 0.89 MEN1 (0.47) MEN1KMT2ACCR1
SCHEMBL703073 0.89 MEN1 (0.47) MEN1KMT2ACCR1
Lithium Ion SCHEMBL701319 0.83 CHRM2 (0.40) GAA
Lithium Ion SCHEMBL701018 0.83 CHRM2 (0.40) GAA

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
US-8124600-B2 5-HT3 receptor modulators, methods of making, and use thereof ALBANY MOLECULAR RESEARCH, INC. (US) 2012-02-28 US disclosed
EP-2310019-A2 5-HT3 RECEPTOR MODULATORS, METHODS OF MAKING, AND USE THEREOF Albany Molecular Research, Inc. (US) 2011-04-20 EP disclosed