Potassium Ion

Potassium Ion

SCHEMBL3677975

Cn1c([S-])nc2c(c1=O)CCCC2.[K+]

nearest known ligand 0.42

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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
KDM4E B2RXH2 6/20 0.42
ALDH1A1 P00352 5/20 0.42
HSD17B10 Q99714 4/20 0.42
GAA P10253 2/20 0.42
HPGD P15428 2/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
KDM5B Q9UGL1 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP2C9 P11712 2/20 0.37
KDM5A P29375 1/20 0.37
NPC1 O15118 2/20 0.37
MAPT P10636 2/20 0.37
RAB9A P51151 2/20 0.37
USP2 O75604 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL7020936 0.76 KDM4E (0.43) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL3679657 0.74 ALDH1A1 (0.55) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL7013477 0.73 ALDH1A1 (0.42) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL1161698 0.72 KDM4E (0.40) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL3522146 0.64 HTR2A (0.47) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL11049965 0.62 SMN1; SMN2 (0.53) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL11449986 0.61 GAA (0.54) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL10860457 0.61 ALDH1A1 (0.54) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL11467166 0.60 GAA (0.40) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL10856015 0.60 ALDH1A1 (0.55) KDM4EALDH1A1HSD17B10GAAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1724267-B1 PYRIMIDINE DERIVATIVE ASKA PHARM CO LTD (JP) 2013-11-06 EP disclosed
US-7799775-B2 such as 3-amino-5,6-dimethyl-2-[3-(4-quinolin-2-ylpiperazin-1-yl)propylthio]-3H-thieno[2,3-d]pyrimidin-4-one, having serotonin receptor modulatory activity, used for treating irritable bowel syndrome ASKA PHARMACEUTICAL CO., LTD. (JP) 2010-09-21 US disclosed
US-20070197551-A1 Pyrimidine derivatives ASKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-23 US disclosed
EP-1724267-A1 PYRIMIDINE DERIVATIVE ASKA Pharmaceutical Co., Ltd. (JP) 2006-11-22 EP 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-20070197551-A1 Pyrimidine derivatives HTR3B, HTR3A, HTR1A KDM4E 4558/4885ALDH1A1 2838/4885HSD17B10 3600/4885

“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.