Potassium Ion

Potassium Ion

SCHEMBL7928665

CCCCCCCCCc1ccc(O)c(CN(C)CC(=O)[O-])c1.[K+]

nearest known ligand 0.51

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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
PTGS1 known ✓ P23219 1/20 0.41
PTGS2 known ✓ P35354 1/20 0.41
KAT8 Q9H7Z6 3/20 0.51
PPARA Q07869 1/20 0.48
GPR84 Q9NQS5 2/20 0.44
BCHE P06276 1/20 0.42
ESR1 P03372 2/20 0.41
ADRA2A P08913 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
TACR2 P21452 2/20 0.41
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
HSD17B10 Q99714 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
SHBG P04278 1/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL536515 0.97 KAT8 (0.51) KAT8PPARAGPR84BCHEESR1
SCHEMBL7925730 0.97 KAT8 (0.51) KAT8PPARAGPR84BCHEESR1
SCHEMBL30206997 0.97 KAT8 (0.51) KAT8PPARAGPR84BCHEESR1
SCHEMBL7928563 0.97 KAT8 (0.51) KAT8PPARAGPR84BCHEESR1
Lithium Ion SCHEMBL7919579 0.97 KAT8 (0.51) KAT8PPARAGPR84BCHEESR1
SCHEMBL7925126 0.92 KAT8 (0.44) KAT8PPARAGPR84BCHEHSD17B10
SCHEMBL28047618 0.89 KAT8 (0.44) KAT8PPARAGPR84HSD17B10TP53
SCHEMBL30624 0.87 KAT8 (0.57) KAT8PPARABCHEESR1ADRA2A
SCHEMBL29634826 0.87 KAT8 (0.57) KAT8PPARABCHEESR1ADRA2A
SCHEMBL2005845 0.86 KAT8 (0.56) KAT8PPARABCHEESR1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0797605-B1 METHODS AND COMPOSITIONS FOR PREPARING RIGID FOAMS WITH NON-CHLOROFLUOROCARBON BLOWING AGENTS STEPAN CO (US) 2001-09-26 EP claimed
US-5157057-A Improved set times ARCO CHEMICAL TECHNOLOGY, L.P. (US) 1992-10-20 US disclosed
US-4101465-A TO POLYISOCYANURATES, ALKALI METAL GLYCINE SALTS, QUATERNARY AMMONM CARBOXYLATES, ALKALI METAL SALTS OF AMIDES AND ACIDS THE UPJOHN COMPANY (US) 1978-07-18 US disclosed