Potassium Ion

Potassium Ion

SCHEMBL6986954

CSc1nccc(C(=O)[O-])n1.[K+]

nearest known ligand 0.41

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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
ALOX15 P16050 1/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.37
LMNA P02545 2/20 0.36
PIK3CA P42336 1/20 0.35
ACACB O00763 1/20 0.34
ALDH1A1 P00352 4/20 0.34
GAA P10253 2/20 0.34
MAPT P10636 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
NTRK1 P04629 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
DYRK3 O43781 1/20 0.33
DYRK1A Q13627 1/20 0.33
DYRK2 Q92630 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33

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
SCHEMBL13202841 0.83 ALOX15 (0.42) ALOX15KMT2AMEN1LMNAPIK3CA
SCHEMBL1735064 0.81 KDM4E (0.49) ALOX15KMT2AMEN1LMNAALDH1A1
SCHEMBL750794 0.81 ALDH1A1 (0.42) ALOX15KMT2AMEN1LMNAPIK3CA
SCHEMBL29835033 0.80 KMT2A (0.46) ALOX15KMT2AMEN1LMNAPIK3CA
SCHEMBL6986951 0.80 KDM4E (0.47) ALOX15KMT2AMEN1LMNAPIK3CA
SCHEMBL6204024 0.80 KMT2A (0.41) ALOX15KMT2AMEN1LMNAPIK3CA
SCHEMBL1785258 0.77 L3MBTL1 (0.45) KMT2AMEN1LMNAALDH1A1GAA
SCHEMBL28067910 0.77 PLK1 (0.41) ALOX15KMT2AMEN1LMNAPIK3CA
Bromide SCHEMBL29100783 0.75 ALOX15 (0.40) ALOX15KMT2AMEN1LMNAPIK3CA
Bromide SCHEMBL29701790 0.75 ALOX15 (0.40) ALOX15KMT2AMEN1LMNAPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1093367-A4 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2003-03-05 EP disclosed
EP-1079821-A4 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2001-08-29 EP disclosed
EP-1093367-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2001-04-25 EP disclosed
EP-1079821-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2001-03-07 EP disclosed
WO-1999066925-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1999-12-29 WO disclosed
WO-1999059570-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1999-11-25 WO disclosed