Potassium Ion

Potassium Ion

SCHEMBL3873536

O=C([O-])c1ccc(Cn2cnc(CNCc3ccc(F)cc3)c2)cc1.[K+]

nearest known ligand 0.45

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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 17)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 2/20 0.45
KDM5B Q9UGL1 2/20 0.45
KDM5A P29375 1/20 0.45
KDM4C Q9H3R0 1/20 0.45
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
KDM4B O94953 1/20 0.40
KDM5C P41229 1/20 0.40
VNN1 O95497 4/20 0.40
HDAC1 Q13547 2/20 0.38
HDAC6 Q9UBN7 1/20 0.38
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 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 SCHEMBL3877708 0.90 KDM5B (0.52) KDM4AKDM5BKDM5AKDM4CKDM4B
Potassium Ion SCHEMBL3885749 0.89 KDM5B (0.43) KDM4AKDM5BKDM5AKDM4CCA1
SCHEMBL3881934 0.88 KDM5A (0.55) KDM4AKDM5BKDM5AKDM4CVNN1
Potassium Ion SCHEMBL3879744 0.86 CYP19A1 (0.47) CA1CA2VNN1HDAC1HDAC2
Potassium Ion SCHEMBL3874287 0.83 KDM5B (0.45) KDM4AKDM5BKDM5AKDM4CCA2
Potassium Ion SCHEMBL3886555 0.81 KDM4C (0.48) KDM4AKDM5BKDM4CKDM4BKDM5C
Potassium Ion SCHEMBL3877293 0.81 HDAC6 (0.36) KDM4AKDM5BKDM5AKDM4CKDM4B
Potassium Ion SCHEMBL3874312 0.81 KDM4A (0.55) KDM4AKDM5BCA1CA2KDM4B
Potassium Ion SCHEMBL3882943 0.79 HDAC1 (0.51) HDAC1HDAC6ALDH1A1SMN1; SMN2HDAC2
SCHEMBL3873546 0.79 KDM5B (0.51) KDM4AKDM5BKDM5AKDM4CKDM4B

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
EP-1910305-B1 IMIDAZOLE DERIVATIVES AS FRUCTOSE-1,6-BISPHOSPHATASE INHIBITORS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM MERCK PATENT GMBH (DE) 2009-08-26 EP claimed