Potassium Ion

Potassium Ion

SCHEMBL22497604

O=C([O-])c1cn(C2CC2)c2ccc(F)cc2c1=O.[K+]

nearest known ligand 0.44

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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 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.44
ALDH1A1 P00352 4/20 0.44
LMNA P02545 3/20 0.44
TOP2A P11388 3/20 0.44
TOP2B Q02880 3/20 0.44
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C9 P11712 1/20 0.44
HTR3A P46098 3/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.40
HTT P42858 1/20 0.39
PIK3CD O00329 2/20 0.39
PIK3R1 P27986 2/20 0.39
PIK3CA P42336 2/20 0.39
PIK3CG P48736 2/20 0.39

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
SCHEMBL2744582 0.87 KDM4E (0.59) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL29766836 0.87 KDM4E (0.59) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL29518174 0.86 MEN1 (0.60) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL22506561 0.86 HTR3A (0.47) KDM4EALDH1A1LMNATOP2ATOP2B
Hydrochloric Acid SCHEMBL6004997 0.86 KDM4E (0.57) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL28458144 0.86 KDM4E (0.57) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL24616680 0.82 HTR3A (0.47) KDM4EALDH1A1LMNATOP2ATOP2B
Trifluoroacetic Acid SCHEMBL3808640 0.81 KDM4E (0.53) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL29766728 0.80 LMNA (0.50) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL10637041 0.79 KDM4E (0.41) KDM4EALDH1A1LMNATOP2ATOP2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020199981-A1 QUINOLINE CARBOXYLIC ACID ESTER COMPOUND AND PREPARATION METHOD AND USE THEREOF 山东省联合农药工业有限公司 2020-10-08 WO disclosed