Potassium Ion

Potassium Ion

SCHEMBL962884

CCCCCS(=O)(=O)[N-]C(=O)/C=C/c1c(C)nn(C)c1-n1nc(C)c2ccccc21.[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 10)

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
CNR2 P34972 4/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
RECQL P46063 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CA9 Q16790 1/20 0.30

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 SCHEMBL962180 0.86 ASAH1 (0.35) ALDH1A1NPC1RAB9ASMN1; SMN2RECQL
Potassium Ion SCHEMBL966080 0.83 ALDH1A1 (0.34) ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL964029 0.83 PPARG (0.40) ALDH1A1NPC1RAB9ASMN1; SMN2CNR2
SCHEMBL964030 0.83 PPARG (0.40) ALDH1A1NPC1RAB9ASMN1; SMN2CNR2
Potassium Ion SCHEMBL963263 0.82 NPC1 (0.31) ALDH1A1NPC1RAB9ASMN1; SMN2
Potassium Ion SCHEMBL963147 0.80 NOTUM (0.33) ALDH1A1NPC1RAB9ASMN1; SMN2CNR2
Potassium Ion SCHEMBL967647 0.79 CNR2 (0.35) ALDH1A1NPC1RAB9ASMN1; SMN2CNR2
SCHEMBL965896 0.77 ALDH1A1 (0.51) ALDH1A1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL965897 0.77 ALDH1A1 (0.51) ALDH1A1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL964447 0.77 NPC1 (0.40) ALDH1A1NPC1RAB9ASMN1; SMN2LMNA

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.