Lithium Ion

Lithium Ion

SCHEMBL15544709

Nc1c(N=Nc2ccc(S(=O)(=O)CCOS(=O)(=O)[O-])cc2)c(S(=O)(=O)O)cc2cc(S(=O)(=O)O)c(N=Nc3cc(Nc4nc(F)nc(F)c4Cl)ccc3S(=O)(=O)[O-])c(O)c12.[Li+].[Na+]

nearest known ligand 0.62

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
▸ THRB P10828 1/20 0.62
▸ ENPP2 Q13822 9/20 0.38
▸ CARM1 Q86X55 1/20 0.35
▸ PRMT1 Q99873 1/20 0.35
▸ FUT8 Q9BYC5 1/20 0.35
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ GRK2 P25098 1/20 0.33
▸ PLEC Q15149 1/20 0.33
▸ CD40 P25942 1/20 0.33
▸ CD40LG P29965 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ PHLPP2 Q6ZVD8 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ PTPN1 P18031 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ CA2 P00918 1/20 0.31

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 SCHEMBL15544707 0.99 THRB (0.63) THRBENPP2CARM1PRMT1FUT8
Lithium Ion SCHEMBL29886706 0.97 THRB (0.66) THRBENPP2CARM1PRMT1FUT8
Lithium Ion SCHEMBL15544703 0.94 THRB (0.60) THRBENPP2CARM1PRMT1FUT8
SCHEMBL18832713 0.92 THRB (0.53) THRBENPP2CARM1PRMT1FUT8
SCHEMBL13880589 0.92 THRB (0.53) THRBENPP2CARM1PRMT1FUT8
SCHEMBL12053477 0.85 THRB (0.46) THRBENPP2FUT8
SCHEMBL14388839 0.81 THRB (0.56) THRBENPP2CARM1PRMT1FUT8
SCHEMBL14388755 0.80 THRB (0.54) THRBENPP2PRMT1FUT8MEN1
SCHEMBL14388939 0.79 THRB (0.55) THRBENPP2CARM1PRMT1FUT8
SCHEMBL109532 0.79 THRB (1.00) THRBENPP2CARM1PRMT1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2877538-B1 HOME FABRIC DYE PRODUCT HENKEL AG & CO KGAA (DE) 2017-09-06 — — EP claimed
EP-2877538-A1 HOME FABRIC DYE PRODUCT Punch Industries (IE) 2015-06-03 — — EP claimed
WO-2014006132-A1 HOME FABRIC DYE PRODUCT PUNCH INDUSTRIES (IE) 2014-01-09 — — WO claimed
EP-3390708-B1 CONSUMER UNIT FOR DYEING TEXTILE HENKEL AG & CO KGAA (DE) 2023-04-05 — — EP disclosed
EP-3390708-A1 CONSUMER UNIT FOR DYEING TEXTILE Henkel AG & Co. KGaA (DE) 2018-10-24 — — EP disclosed
EP-2877538-B1 HOME FABRIC DYE PRODUCT HENKEL AG & CO KGAA (DE) 2017-09-06 — — EP disclosed
WO-2017102314-A1 CONSUMER UNIT FOR DYEING TEXTILE HENKEL AG & CO. KGAA (DE) 2017-06-22 — — WO disclosed
EP-2877538-A1 HOME FABRIC DYE PRODUCT Punch Industries (IE) 2015-06-03 — — EP disclosed
WO-2014006132-A1 HOME FABRIC DYE PRODUCT PUNCH INDUSTRIES (IE) 2014-01-09 — — WO disclosed
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