Potassium Ion

Potassium Ion

SCHEMBL28870541

COC(=O)c1ccc(N)cc1OC.[K+].[OH-]

nearest known ligand 0.67

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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
ALDH1A1 P00352 4/20 0.67
GAA P10253 6/20 0.62
KDM4E B2RXH2 4/20 0.54
POLB P06746 1/20 0.50
MAPT P10636 4/20 0.49
HSD17B10 Q99714 3/20 0.49
HPGD P15428 2/20 0.49
GLA P06280 1/20 0.49
CASP1 P29466 1/20 0.49
CASP7 P55210 1/20 0.49
ATM Q13315 1/20 0.49
ABL1 P00519 1/20 0.47
CRBN Q96SW2 1/20 0.46
HTR4 Q13639 1/20 0.45
CFTR P13569 2/20 0.44
TSHR P16473 2/20 0.44
HTT P42858 2/20 0.44
MAPK1 P28482 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 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
SCHEMBL224165 0.96 ALDH1A1 (0.71) ALDH1A1GAAKDM4EPOLBMAPT
Hydrochloric Acid SCHEMBL7410231 0.95 ALDH1A1 (0.69) ALDH1A1GAAKDM4EPOLBMAPT
SCHEMBL31321291 0.87 GAA (0.58) ALDH1A1GAAKDM4EPOLBMAPT
SCHEMBL1761307 0.83 ALDH1A1 (0.54) ALDH1A1GAAKDM4EPOLBMAPT
SCHEMBL570110 0.82 GAA (0.61) ALDH1A1GAAKDM4EPOLBMAPT
SCHEMBL8000660 0.82 ALDH1A1 (0.76) ALDH1A1GAAKDM4EMAPTHSD17B10
SCHEMBL15055753 0.81 GAA (0.60) ALDH1A1GAAKDM4EPOLBMAPT
Hydrochloric Acid SCHEMBL15488205 0.81 GAA (0.59) ALDH1A1GAAKDM4EPOLBMAPT
Hydrochloric Acid SCHEMBL7564049 0.81 GAA (0.59) ALDH1A1GAAKDM4EPOLBMAPT
SCHEMBL1354320 0.80 ALDH1A1 (0.73) ALDH1A1GAAKDM4EMAPTHPGD

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
CN-109456267-A A method of synthesis pleasure is cut down for Buddhist nun 南京天越星生物技术有限公司 2019-03-12 CN disclosed