Lithium Ion

Lithium Ion

SCHEMBL28396394

Cc1cc(C)c(CP(=O)([O-])c2ccccc2)c(C)c1.[Li+]

nearest known ligand 0.39

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
HTT P42858 1/20 0.39
CFTR P13569 1/20 0.36
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
RAB9A P51151 1/20 0.35
MAPK1 P28482 1/20 0.35
ALDH1A1 P00352 2/20 0.34
FFAR4 Q5NUL3 1/20 0.33
PGK1 P00558 1/20 0.33
PGK2 P07205 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PTPN2 P17706 2/20 0.33
PTPN1 P18031 2/20 0.33
PTPN4 P29074 2/20 0.33
PTPN9 P43378 2/20 0.33
PTPN11 Q06124 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL35192 0.81 HTT (0.53) HTTMEN1KMT2AALDH1A1NPSR1
SCHEMBL1326156 0.81 HTT (0.41) HTTCFTRMEN1KMT2AMAPK1
SCHEMBL19008528 0.79 CFTR (0.52) HTTCFTRMEN1KMT2AALDH1A1
SCHEMBL1559114 0.77 HTT (0.45) HTTMEN1KMT2AALDH1A1NPSR1
SCHEMBL18955117 0.77 HTT (0.39) HTTCFTRMEN1KMT2ARAB9A
SCHEMBL28089769 0.75 ALDH1A1 (0.39) HTTCFTRMEN1KMT2AMAPK1
Lithium Ion SCHEMBL18939416 0.74 FFAR4 (0.36) HTTCFTRALDH1A1FFAR4NPSR1
SCHEMBL2304233 0.73 AOX1 (0.50) HTTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL1203711 0.70 CFTR (0.40) HTTCFTRMEN1KMT2AALDH1A1
SCHEMBL27795097 0.70 MEN1 (0.50) HTTCFTRMEN1KMT2AALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115746412-A Water-soluble chitosan composite hydrogel and preparation method and application thereof 南方科技大学 2023-03-07 CN disclosed
CN-113749825-B Frame type bone joint prosthesis and preparation method and application thereof 浙江大学 2022-08-05 CN disclosed
CN-113749825-A Frame type bone joint prosthesis and preparation method and application thereof 浙江大学 2021-12-07 CN disclosed
CN-107286359-B Hydrogel with heterogeneous multilayer structure and preparation method thereof 上普博源(北京)生物科技有限公司 2020-05-22 CN disclosed