Lithium Ion

Lithium Ion

SCHEMBL702082

O=C([O-])c1cccc2c1c(CN[C@H]1CN3CCC1CC3)nn2Cc1ccccc1.[Li+]

nearest known ligand 0.44

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 7)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 1/20 0.44
GAA P10253 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
CHRNA7 P36544 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
USP30 Q70CQ3 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
SCHEMBL4324126 0.92 HTR3A (0.46) HTR3AGAASMN1; SMN2CHRNA7MEN1
SCHEMBL701109 0.92 HTR3A (0.46) HTR3AGAASMN1; SMN2CHRNA7MEN1
Lithium Ion SCHEMBL701115 0.91 HTR3A (0.43) HTR3AGAACHRNA7USP30
Lithium Ion SCHEMBL702639 0.91 HTR3A (0.43) HTR3AGAACHRNA7USP30
SCHEMBL702083 0.91 HTR3A (0.45) HTR3AGAASMN1; SMN2CHRNA7MEN1
SCHEMBL702524 0.89 HTR3A (0.43) HTR3AGAASMN1; SMN2
SCHEMBL702525 0.89 HTR3A (0.43) HTR3AGAASMN1; SMN2
Lithium Ion SCHEMBL702370 0.88 HTR3A (0.42) HTR3AGAA
Lithium Ion SCHEMBL699991 0.88 HTR3A (0.42) HTR3AGAA
Lithium Ion SCHEMBL701408 0.86 HTR3A (0.36) HTR3AGAA

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
US-8124600-B2 5-HT3 receptor modulators, methods of making, and use thereof ALBANY MOLECULAR RESEARCH, INC. (US) 2012-02-28 US disclosed