Potassium Ion

Potassium Ion

SCHEMBL11799623

CC(=O)c1cc(Cl)c(O)c([N+](=O)[O-])c1.[K+]

nearest known ligand 0.68

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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
▸ PTGS2 known ✓ P35354 1/20 0.43
▸ GPR35 Q9HC97 8/20 0.57
▸ TTR P02766 3/20 0.49
▸ VCAM1 P19320 2/20 0.47
▸ ABCC3 O15438 1/20 0.43
▸ ABCC4 O15439 1/20 0.43
▸ NR1I2 O75469 1/20 0.43
▸ ABCB11 O95342 1/20 0.43
▸ NR3C1 P04150 1/20 0.43
▸ PGR P06401 1/20 0.43
▸ HTR1A P08908 1/20 0.43
▸ ADORA3 P0DMS8 1/20 0.43
▸ RARB P10826 1/20 0.43
▸ COMT P21964 1/20 0.43
▸ SLC6A2 P23975 1/20 0.43
▸ ADORA1 P30542 1/20 0.43
▸ ADRA1A P35348 1/20 0.43
▸ SLC6A3 Q01959 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ KLF10 Q13118 1/20 0.43

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
SCHEMBL11802620 0.98 GPR35 (0.59) GPR35TTRVCAM1ABCC3ABCC4
Potassium SCHEMBL11799629 0.97 GPR35 (0.57) GPR35TTRVCAM1ABCC3ABCC4
SCHEMBL11799616 0.97 GPR35 (0.57) GPR35TTRVCAM1ABCC3ABCC4
SCHEMBL11799631 0.86 GPR35 (0.61) GPR35TTRABCC3ABCC4NR1I2
SCHEMBL12727246 0.83 GPR35 (0.57) GPR35TTRVCAM1ABCC3ABCC4
SCHEMBL3770749 0.83 TTR (0.62) GPR35TTRVCAM1ALDH1A1LMNA
SCHEMBL11150662 0.83 VCAM1 (0.50) GPR35VCAM1MAPTALDH1A1LMNA
SCHEMBL4901895 0.83 GPR35 (0.61) GPR35TTRVCAM1ABCC3ABCC4
SCHEMBL6036460 0.81 TTR (0.62) GPR35TTRABCC3ABCC4NR1I2
SCHEMBL11817166 0.81 GPR35 (0.54) GPR35TTRVCAM1ABCC3ABCC4

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-3933472-A Substituted alkylaryl ketones and methods of use as herbicides BUCKMAN LABORATORIES, INC. (US) 1976-01-20 — — US disclosed
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