Potassium Ion

Potassium Ion

SCHEMBL966080

CCCCCS(=O)(=O)[N-]C(=O)/C=C/c1c(C)nn(C)c1-n1ccc2ccccc21.[K+]

nearest known ligand 0.34

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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 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TLR8 Q9NR97 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
PHGDH O43175 1/20 0.33
PTPN1 P18031 1/20 0.32
HTT P42858 1/20 0.31

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 SCHEMBL964247 0.89 MAPT (0.32)
Potassium Ion SCHEMBL963186 0.88
Potassium Ion SCHEMBL965147 0.88 PTGDR2 (0.31) ALDH1A1
Potassium Ion SCHEMBL963263 0.88 NPC1 (0.31) ALDH1A1NPC1RAB9ASMN1; SMN2
Potassium Ion SCHEMBL961574 0.88 MTNR1A (0.36) ALDH1A1SMN1; SMN2
Potassium Ion SCHEMBL966881 0.87 HDAC3 (0.32) ALDH1A1NPC1RAB9ASMN1; SMN2
Potassium Ion SCHEMBL962489 0.87
Potassium Ion SCHEMBL966635 0.87 MTNR1A (0.36)
Potassium Ion SCHEMBL963147 0.86 NOTUM (0.33) ALDH1A1NPC1RAB9ASMN1; SMN2HTT
SCHEMBL968312 0.86 MAPT (0.36) SMN1; SMN2HTT

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
US-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA PPARA, PPARD, PPARG ALDH1A1 821/4885NPC1 1538/4885RAB9A 2322/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.