Lithium Ion

Lithium Ion

SCHEMBL5151682

Cc1cc(C)c2ccc(C(=O)[O-])nc2c1.[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 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 8/20 0.44
ALDH1A1 P00352 2/20 0.42
MAPT P10636 4/20 0.40
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MPI P34949 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PSMB5 P28074 2/20 0.39
RAB9A P51151 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
PSMB1 P20618 1/20 0.38
HIPK2 Q9H2X6 1/20 0.37
POLB P06746 1/20 0.37
CFTR P13569 2/20 0.36
TYMS P04818 1/20 0.35
NPC1 O15118 2/20 0.34
TSHR P16473 2/20 0.34
CASP1 P29466 2/20 0.34
HSD17B10 Q99714 2/20 0.34

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
SCHEMBL2471847 0.83 KDM4E (0.41) GRM2ALDH1A1MAPTKDM4ERAB9A
SCHEMBL19272942 0.77 PSMB5 (0.41) GRM2ALDH1A1MAPTKDM4EMEN1
SCHEMBL3207562 0.75 ALDH1A1 (0.46) GRM2ALDH1A1MAPTKDM4EMEN1
SCHEMBL24188646 0.72 PSMB5 (0.45) GRM2ALDH1A1MAPTKDM4EMEN1
SCHEMBL31186680 0.71 POLB (0.55) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL1562526 0.71 POLB (0.55) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL28280669 0.69 KDM4E (0.51) GRM2ALDH1A1MAPTKDM4EMEN1
SCHEMBL30502987 0.68 POLB (0.52) GRM2ALDH1A1MAPTKDM4EMEN1
SCHEMBL4101758 0.68 POLB (0.52) GRM2ALDH1A1MAPTKDM4EMEN1
SCHEMBL15448472 0.68 NQO2 (0.42) GRM2ALDH1A1MAPTKDM4EKMT2A

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-20070200096-A1 Doped lithium quinolate OLED-T LIMITED (GB) 2007-08-30 US claimed