Lithium Ion

Lithium Ion

SCHEMBL7706983

COc1ccc2c(c1)[C@@H](c1ccccc1)[C@@H](CN(C)CC(=O)[O-])CC2.[Li+]

nearest known ligand 0.71

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 8)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 2/20 0.71
MTNR1A P48039 13/20 0.43
MTNR1B P49286 12/20 0.43
TAS2R14 Q9NYV8 1/20 0.43
KDM1A O60341 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
NQO2 P16083 10/20 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
Org-25935 SCHEMBL7704305 0.92 SLC6A9 (0.85) SLC6A9MTNR1AMTNR1BTAS2R14
Org-25935 SCHEMBL7703028 0.92 SLC6A9 (0.85) SLC6A9MTNR1AMTNR1BTAS2R14
Lithium Ion SCHEMBL7698448 0.86 SLC6A9 (0.54) SLC6A9MTNR1AMTNR1B
Lithium Ion SCHEMBL7703313 0.86 SLC6A9 (0.74) SLC6A9MTNR1ATAS2R14
Org-25935 SCHEMBL27034881 0.83 SLC6A9 (1.00) SLC6A9MTNR1AMTNR1BTAS2R14
Org-25935 SCHEMBL7703430 0.83 SLC6A9 (1.00) SLC6A9MTNR1AMTNR1BTAS2R14
Org-25935 SCHEMBL1761267 0.83 SLC6A9 (1.00) SLC6A9MTNR1AMTNR1BTAS2R14
Lithium Ion SCHEMBL7700187 0.83 SLC6A9 (0.70) SLC6A9MTNR1AMTNR1B
Org-25935 SCHEMBL7703262 0.82 SLC6A9 (0.98) SLC6A9MTNR1AMTNR1BTAS2R14
Lithium Ion SCHEMBL7704525 0.82 SLC6A9 (0.69) SLC6A9MTNR1AMTNR1B

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
EP-1100769-B1 AMINOMETHYLCARBOXYLIC ACID DERIVATIVES AKZO NOBEL NV (NL) 2002-12-04 EP disclosed
US-6410592-B1 THERAPY FOR CENTRAL NERVOUS SYSTEM DISORDERS, PSYCHOLOGICAL DISORDERS AKZO NOBEL N.V. (NL) 2002-06-25 US disclosed