Potassium Ion

Potassium Ion

SCHEMBL472981

O=C([O-])c1ccccc1CCCCCO.[K+]

nearest known ligand 0.40

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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 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
SLC16A3 O15427 10/20 0.40
FOLH1 Q04609 1/20 0.40
DHODH Q02127 1/20 0.39
CA2 P00918 1/20 0.37
BID P55957 1/20 0.36
BCL2L1 Q07817 1/20 0.36
MCL1 Q07820 1/20 0.36
BAK1 Q16611 1/20 0.36
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36

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
Potassium Ion SCHEMBL8054009 0.98 ALDH1A1 (0.41) KDM4EALDH1A1HPGDSLC16A3FOLH1
Potassium Ion SCHEMBL1841509 0.85 LIPG (0.53) ALDH1A1BIDBCL2L1MCL1BAK1
Potassium Ion SCHEMBL29022858 0.83 LIPG (0.50) ALDH1A1BIDBCL2L1MCL1BAK1
SCHEMBL28246094 0.82 FOLH1 (0.59) ALDH1A1SLC16A3FOLH1DHODHBID
SCHEMBL25387444 0.82 FOLH1 (0.59) ALDH1A1SLC16A3FOLH1DHODHBID
SCHEMBL16504646 0.82 ALDH1A1 (0.50) KDM4EALDH1A1HPGDFOLH1CA2
SCHEMBL10424886 0.81 LIPG (0.53) ALDH1A1BIDBCL2L1MCL1BAK1
SCHEMBL7920922 0.81 LIPG (0.53) ALDH1A1BIDBCL2L1MCL1BAK1
SCHEMBL7920926 0.81 LIPG (0.53) ALDH1A1BIDBCL2L1MCL1BAK1
SCHEMBL11803044 0.81 LIPG (0.53) ALDH1A1BIDBCL2L1MCL1BAK1

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
EP-2332530-A4 THE USE OF POTASSIUM 2-( - HYDROXYPENTYL) BENZOATE IN THE MANUFACTURE OF MEDICAMENTS FOR PREVENTING AND/OR TREATING SENILE DEMENTIA INST MATERIA MEDICA CAMS (CN) 2012-02-01 EP disclosed
EP-2332530-A1 THE USE OF POTASSIUM 2-( - HYDROXYPENTYL) BENZOATE IN THE MANUFACTURE OF MEDICAMENTS FOR PREVENTING AND/OR TREATING SENILE DEMENTIA INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2011-06-15 EP disclosed