Potassium Ion

Potassium Ion

SCHEMBL27359160

CC(C)=COC(=O)CCC(=O)[O-].[K+]

nearest known ligand 0.39

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Known targets — ChEMBL curated mechanism

AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA

The experimentally established mechanism targets of Potassium Ion. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 2/20 0.36
HDAC3 O15379 2/20 0.36
HDAC1 Q13547 2/20 0.36
HDAC2 Q92769 2/20 0.36
HDAC8 Q9BY41 2/20 0.36
FABP3 P05413 5/20 0.32
CA1 P00915 3/20 0.32
TSHR P16473 1/20 0.32
CA4 P22748 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
SCHEMBL8951891 0.96 FFAR3 (0.39) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL446877 0.87 TSHR (0.41) TSHR
SCHEMBL848574 0.78 PHF8 (0.45) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL28047872 0.78 TSHR (0.59) TSHR
SCHEMBL28049493 0.77 TSHR (0.33) TSHR
SCHEMBL5690184 0.77 TSHR (0.33) TSHR
SCHEMBL28236422 0.76 SQLE (0.31) TSHR
SCHEMBL28296514 0.76 ALDH1A1 (0.50) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL27574835 0.75 TSHR (0.32) TSHR
SCHEMBL28488361 0.71 FFAR3 (0.39) FFAR3HDAC3HDAC1HDAC2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1285713-C Method for preparing polyisobutylene base oil soluble organic molybdenum lubricating additives UNIV SHANGHAI (CN) 2006-11-22 CN claimed
CN-1632084-A Method for preparing polyisobutylene base oil soluble organic molybdenum lubricating additives UNIV SHANGHAI (CN) 2005-06-29 CN claimed
CN-1285713-C Method for preparing polyisobutylene base oil soluble organic molybdenum lubricating additives UNIV SHANGHAI (CN) 2006-11-22 CN disclosed
CN-1632084-A Method for preparing polyisobutylene base oil soluble organic molybdenum lubricating additives UNIV SHANGHAI (CN) 2005-06-29 CN disclosed
CN-1062752-A GASOLINE COMPOSITION SHELL INT RESEARCH (NL) 1992-07-15 CN disclosed