Potassium Ion

Potassium Ion

SCHEMBL3877708

O=C([O-])c1ccc(Cn2cnc(CNCc3ccccc3)c2)cc1.[K+]

nearest known ligand 0.52

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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
KDM5B Q9UGL1 2/20 0.52
KDM4A O75164 2/20 0.52
KDM5C P41229 2/20 0.52
KDM4B O94953 1/20 0.52
HDAC6 Q9UBN7 3/20 0.43
KDM4C Q9H3R0 2/20 0.43
KDM5A P29375 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC1 Q13547 1/20 0.41
CYP19A1 P11511 2/20 0.41
CDK5 Q00535 1/20 0.40
CDK5R1 Q15078 1/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM2A Q9Y2K7 1/20 0.39
KDM3A Q9Y4C1 1/20 0.39
TRHDE Q9UKU6 1/20 0.39
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38

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 SCHEMBL3885749 0.90 KDM5B (0.43) KDM5BKDM4AKDM5CKDM4BKDM4C
Potassium Ion SCHEMBL3873536 0.90 KDM4A (0.45) KDM5BKDM4AKDM5CKDM4BHDAC6
SCHEMBL3873546 0.89 KDM5B (0.51) KDM5BKDM4AKDM5CKDM4BHDAC6
Potassium Ion SCHEMBL3874287 0.89 KDM5B (0.45) KDM5BKDM4AKDM5CKDM4BHDAC6
Potassium Ion SCHEMBL3879744 0.87 CYP19A1 (0.47) HDAC8HDAC1CYP19A1CDK5CDK5R1
Potassium Ion SCHEMBL3886555 0.85 KDM4C (0.48) KDM5BKDM4AKDM5CKDM4BHDAC6
Potassium Ion SCHEMBL3882943 0.85 HDAC1 (0.51) HDAC6HDAC8HDAC1CDK5CDK5R1
Potassium Ion SCHEMBL3874312 0.84 KDM4A (0.55) KDM5BKDM4AKDM5CKDM4BSMN1; SMN2
SCHEMBL3877779 0.80 ALDH1A1 (0.48) KDM5BKDM4AKDM4CKDM5ACYP19A1
SCHEMBL3881934 0.80 KDM5A (0.55) KDM5BKDM4AKDM4CKDM5ASMN1; SMN2

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