Potassium Ion

Potassium Ion

SCHEMBL30940403

O=C([O-])C(=CO)Cc1ccccc1.[K+]

nearest known ligand 0.56

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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 20)

geneUniProtsupporting neighboursconfidence
PTGS1 known ✓ P23219 1/20 0.39
CES1 P23141 3/20 0.56
CES2 O00748 2/20 0.56
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
AKR1B1 P15121 1/20 0.50
FNTA P49354 1/20 0.47
FNTB P49356 1/20 0.47
HDAC8 Q9BY41 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CTBP2 P56545 1/20 0.41
EPHX2 P34913 1/20 0.41
PAM P19021 2/20 0.40
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40

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
SCHEMBL11275826 0.98 CES1 (0.54) CES1CES2CYP3A4CYP2C9AKR1B1
SCHEMBL8921169 0.83 CYP3A4 (0.66) CES1CES2CYP3A4CYP2C9AKR1B1
SCHEMBL30940459 0.82 CYP3A4 (0.63) CES1CES2CYP3A4CYP2C9AKR1B1
SCHEMBL11878518 0.80 CYP3A4 (0.52) CES1CES2CYP3A4CYP2C9AKR1B1
SCHEMBL8517083 0.80 CYP3A4 (0.52) CES1CES2CYP3A4CYP2C9AKR1B1
SCHEMBL11878522 0.80 CYP3A4 (0.52) CES1CES2CYP3A4CYP2C9AKR1B1
SCHEMBL11876245 0.78 CYP3A4 (0.50) CES1CES2CYP3A4CYP2C9AKR1B1
Phenylacetic Acid SCHEMBL541980 0.78 CES1 (0.71) CES1CES2CYP3A4CYP2C9AKR1B1
Phenylpyruvate SCHEMBL9218269 0.76 CES1 (0.76) CES1CES2AKR1B1FNTAFNTB
SCHEMBL9456021 0.76 CYP3A4 (0.47) CES1CES2CYP3A4CYP2C9AKR1B1

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
CN-118367119-A Organic matter modified carbon-based negative electrode material and manufacturing method thereof 贵州创德新能源科技有限公司 2024-07-19 CN claimed
CN-118367119-A Organic matter modified carbon-based negative electrode material and manufacturing method thereof 贵州创德新能源科技有限公司 2024-07-19 CN disclosed